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RInChI Example. RInChI=1.00.1S/<>C2H3N/c1-2-3/h1H3!C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)<>CH2Cl2/c2-1-3/h1H2/d-.

RInChI Example. RInChI=1.00.1S/BrH/h1H!C6H7NO2/c8-4-5-1-2-7-6(9)3-5/h1-3,8H,4H2,(H,7,9)<>C6H6BrNO/c7-4-5-1-2-8-6(9)3-5/h1-3H,4H2,(H,8,9)/d+. RAuxInfo=1.00.1/0/N:1/rA:1Br/rB:/rC:;!1/N:1,2,3,4,5,6,7,8,9/rA:9CCCCCCNOO/rB:d1;;;s1d3s4;s3;s2d6;s4;s6;/rC:;;

RInChI Example. RInChI=1.00.1S/Al.3ClH/h;31H/q3;;;/p-3!C4H6O2/c1-2-3-4(5)6/h2-3H,1H3,(H,5,6)!C6H6/c1-2-4-6-5-3-1/h1-6H<>C10H10O/c1-7-6-10(11)9-5-3-2-4-8(7)9/h2-5,7H,6H2,1H3/d+. RAuxInfo=1.00.1/1/N:1;2;3;4/rA:4Al3Cl-Cl-Cl-/rB:;;;/rC:;;;;!1/N:1,2,3,4,5

RInChI Example. RInChI=1.00.1S/<>C6H9F2NO2/c1-11-5(10)4-2-6(7,8)3-9-4/h4,9H,2-3H2,1H3<>C4H8O/c1-2-4-5-3-1/h1-4H2!Mn.2O/d-.

RInChI Example. RInChI=1.00.1S/<>C2H3N/c1-2-3/h1H3!C6H6O3S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H,7,8,9)<>CH2Cl2/c2-1-3/h1H2/d-.

RInChI Example. RInChI=1.00.1S/2C4H9.Al.H/c21-4(2)3;;/h24H,1H2,2-3H3;;!C10H10Cl2N2O4/c1-16-5-6(11)13-9(12)14-7(5)18-10(3-4-10)8(15)17-2/h3-4H2,1-2H3<>C9H10Cl2N2O3/c1-15-5-6(10)12-8(11)13-7(5)16-9(4-14)2-3-9/h14H,2-4H2,1H3<>CH2Cl2/c2-1-3/h1H2/d+.

RInChI Example. RInChI=1.00.1S/C11H15NO2/c1-14-11(13)4-2-3-9-5-7-10(12)8-6-9/h5-8H,2-4,12H2,1H3!CH5N.CH4O/c21-2/h2H2,1H3;2H,1H3<>C11H16N2O/c1-13-11(14)4-2-3-9-5-7-10(12)8-6-9/h5-8H,2-4,12H2,1H3,(H,13,14)/d+.

RInChI Example. RInChI=1.00.1S/<>2K.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4)/q21;/p-2!CClF3O2S/c2-8(6,7)1(3,4)5<>C2H3N/c1-2-3/h1H3/d-. RAuxInfo=1.00.1/<>1/N:1;2;3,4,5,6,7/E:;;(1,2,3,4)/rA:7KKO-O-OOP/rB:;;;;;s3s4s5d6;/rC:;;;;;;;!0/N:1,2,3,4,5,6,7,8/E:(3,4,5

RInChI Example. RInChI=1.00.1S/<>C10H13N/c1-2-4-9(5-3-1)10-6-7-11-8-10/h1-5,10-11H,6-8H2!Na.H/q1;-1<>C4H8O/c1-2-4-5-3-1/h1-4H2/d-. RAuxInfo=1.00.1/<>0/N:1,2,3,4,5,6,7,8,9,10,11/E:(2,3)(4,5)/rA:11CCCCCCCCCCN/rB:d1;s1;s2;d3;;s6;;d4s5;s6s8s9;s7s8;/rC:;;

RInChI Example. RInChI=1.00.1S/C3H7ClO/c1-5-3-2-4/h2-3H2,1H3!C4H9N/c1-2-4-5-3-1/h5H,1-4H2<>C7H15NO/c1-9-7-6-8-4-2-3-5-8/h2-7H2,1H3/d+.

RInChI Example. RInChI=1.00.1S/<>C2H3N/c1-2-3/h1H3!C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)<>CH2Cl2/c2-1-3/h1H2/d-.

RInChI Example. RInChI=1.00.1S/C3H7ClO/c1-5-3-2-4/h2-3H2,1H3!C4H9NO/c1-3-6-4-2-5-1/h5H,1-4H2<>C7H15NO2/c1-9-5-2-8-3-6-10-7-4-8/h2-7H2,1H3/d+. RAuxInfo=1.00.1/0/N:1,2,3,4,5/rA:5CCCClO/rB:;s2;s2;s1s3;/rC:;;;;;!0/N:1,2,3,4,5,6/E:(1,2)(3,4)/rA:6CCCCNO/rB

RInChI Example. RInChI=1.00.1S/<>C7H5ClO3/c8-6-3-1-2-5(4-6)7(9)11-10/h1-4,10H!Na.H2O3S/c;1-4(2)3/h;(H2,1,2,3)/q1;/p-1<>C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3/d-.

RInChI Example. RInChI=1.00.1S/<>C10H6Cl2N4S/c1-17-10(15-5-14)16-6-2-8(11)7(4-13)9(12)3-6/h2-3H,1H3,(H,15,16)!H4N2/c1-2/h1-2H2<>C2H6O/c1-2-3/h3H,2H2,1H3/d-.

RInChI Example. RInChI=1.00.1S/<>C11H8F3N3O3/c12-11(13,14)19-7-3-1-6(2-4-7)8-5-9(20-17-8)10(18)16-15/h1-5H,15H2,(H,16,18)!C2H6N2.ClH/c1-2(3)4;/h1H3,(H3,3,4);1H!Na.H2O/h;1H2/q1;/p-1<>C4H8O/c1-2-4-5-3-1/h1-4H2/d-.

RInChI Example. RInChI=1.00.1S/C12H21NO4/c1-8(14)16-7-9-5-10(6-9)13-11(15)17-12(2,3)4/h9-10H,5-7H2,1-4H3,(H,13,15)!ClH/h1H<>C7H13NO2/c1-5(9)10-4-6-2-7(8)3-6/h6-7H,2-4,8H2,1H3<>C4H8O2/c1-2-6-4-3-5-1/h1-4H2/d+.

RInChI Example. RInChI=1.00.1S/<>C9H10N4O2S2/c1-16-9(12-6-10)13-7-2-4-8(5-3-7)17(11,14)15/h2-5H,1H3,(H,12,13)(H2,11,14,15)!H4N2/c1-2/h1-2H2<>C2H6O/c1-2-3/h3H,2H2,1H3/d-. RAuxInfo=1.00.1/1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17/E:(2,3)(4,5)(14,15

RInChI Example. RInChI=1.00.1S/<>C10H12N4O2S2/c1-12-18(15,16)9-5-3-8(4-6-9)14-10(17-2)13-7-11/h3-6,12H,1-2H3,(H,13,14)!H4N2/c1-2/h1-2H2<>C2H6O/c1-2-3/h3H,2H2,1H3/d-. RAuxInfo=1.00.1/1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18/E:(3,4)(5,6)(15,16)

RInChI Example. RInChI=1.00.1S/<>C11H11Cl2N3O2S/c1-18-10(17)9-7(12)3-6(4-8(9)13)16-11(19-2)15-5-14/h3-4,11,15-16H,1-2H3!H4N2/c1-2/h1-2H2<>C2H6O/c1-2-3/h3H,2H2,1H3/d-. RAuxInfo=1.00.1/0/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19/E:(3,4)(7,8)(12

RInChI Example. RInChI=1.00.1S/C10H14/c1-3-9-7-5-6-8-10(9)4-2/h5-8H,3-4H2,1-2H3<>C2H6O/c1-2-3/h3H,2H2,1H3!C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3/d-.

RInChI Example. RInChI=1.00.1S/<>C11H14N4O2S2/c1-15(2)19(16,17)10-6-4-9(5-7-10)14-11(18-3)13-8-12/h4-7H,1-3H3,(H,13,14)!H4N2/c1-2/h1-2H2<>C2H6O/c1-2-3/h3H,2H2,1H3/d-.

RInChI Example. RInChI=1.00.1S/<>C15H17N5O2S/c1-9-7-10(2)20(19-9)14(16)18-15(23)17-12-6-4-5-11(8-12)13(21)22-3/h4-8H,1-3H3,(H3,16,17,18,23)!H4N2/c1-2/h1-2H2<>CH4O/c1-2/h2H,1H3/d-. RAuxInfo=1.00.1/1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20

RInChI Example. RInChI=1.00.1S/CH5N3/c2-1(3)4/h(H5,2,3,4)<>CH5N3/c2-1(3)4/h(H5,2,3,4)/p1<>C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)/d+. RAuxInfo=1.00.1/1/N:1,2,3,4/E:(2,3,4)/rA:4CNNN/rB:d1;s1;s1;/rC:;;;;<>1/N:1,2,3,4/E:(2,3,4)/rA

RInChI Example. RInChI=1.00.1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)!C8H8O4/c1-6(10)11-5-8-3-2-7(4-9)12-8/h2-4H,5H2,1H3<>C6H4O4/c7-3-4-1-2-5(10-4)6(8)9/h1-3H,(H,8,9)/d+.

RInChI Example. RInChI=1.00.1S/<>C14H14ClN5O2S/c1-18-13(21)5-6-20(14(18)22)12-4-3-10(7-11(12)15)17-9-19(8-16)23-2/h3-7,17H,9H2,1-2H3!H4N2/c1-2/h1-2H2<>C2H6O/c1-2-3/h3H,2H2,1H3/d-. RAuxInfo=1.00.1/0/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20

RInChI Example. RInChI=1.00.1S/C6H4FNO3/c7-5-3-4(8(10)11)1-2-6(5)9/h1-3,9H<>C6H6FNO/c7-5-3-4(8)1-2-6(5)9/h1-3,9H,8H2<>C2H6O/c1-2-3/h3H,2H2,1H3!Pd/d+.

RInChI Example. RInChI=1.00.1S/<>C15H15Cl2N3S/c1-15(2,3)6-5-11-12(16)7-10(8-13(11)17)20-14(21-4)19-9-18/h7-8H,1-4H3,(H,19,20)!H4N2/c1-2/h1-2H2<>C2H6O/c1-2-3/h3H,2H2,1H3/d-.

RInChI Example. RInChI=1.00.1S/C3H6O/c1-2-3-4/h3H,2H2,1H3<>C3H6O/c1-3(2)4/h1-2H3!C3H8O/c1-2-3-4/h4H,2-3H2,1H3<>C3H8O/c1-3(2)4/h3-4H,1-2H3!C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3/d-.

RInChI Example. RInChI=1.00.1S/C11H11BrO2S/c1-7(2)4-5-8-6-9(12)10(15-8)11(13)14-3/h6-7H,1-3H3<>C4H8O/c1-2-4-5-3-1/h1-4H2!C6H15N/c1-4-7(5-2)6-3/h4-6H2,1-3H3!C6H4BrIO2S/c1-10-6(9)5-3(7)2-4(8)11-5/h2H,1H3<>C4H10O/c1-3-5-4-2/h3-4H2,1-2H3!Cu.HI/h;1H/q1;/p

RInChI Example. RInChI=1.00.1S/<>C6H5N3O/c10-9-6-4-2-1-3-5(6)7-8-9/h1-4,10H!C8H17N3/c1-4-9-8-10-6-5-7-11(2)3/h4-7H2,1-3H3!ClH.H3N/h1H;1H3<>C3H7NO/c1-4(2)3-5/h3H,1-2H3/d-.

RInChI Example. RInChI=1.00.1S/C8H15NO2/c1-7(2)6(9-11)4-5-8(7,3)10/h10-11H,4-5H2,1-3H3!Na<>C8H17NO/c1-7(2)6(9)4-5-8(7,3)10/h6,10H,4-5,9H2,1-3H3<>C3H8O/c1-2-3-4/h4H,2-3H2,1H3/d+. RAuxInfo=1.00.1/0/N:1,2,3,4,5,6,7,8,9,10,11/E:(1,2)/rA:11CCCCCCCCNOO/rB:

RInChI Example. RInChI=1.00.1S/C12H23NO4/c1-11(2,3)17-10(15)13(6)8-12(4,5)9(14)16-7/h8H2,1-7H3!C4H8O2/c1-2-6-4-3-5-1/h1-4H2!ClH/h1H<>C7H15NO2/c1-7(2,5-8-3)6(9)10-4/h8H,5H2,1-4H3<>C4H8O/c1-2-4-5-3-1/h1-4H2/d+.

RInChI Example. RInChI=1.00.1S/<>C13H11F3N4O2S/c1-7(17)19-20-11(21)12-18-10(6-23-12)8-2-4-9(5-3-8)22-13(14,15)16/h2-6H,1H3,(H2,17,19)(H,20,21)!H2O/h1H2<>C2H6O2/c3-1-2-4/h3-4H,1-2H2/d-.

RInChI Example. RInChI=1.00.1S/C21H20FNO2/c1-3-25-21(24)20-19(17-9-11-18(22)12-10-17)15(2)13-23(20)14-16-7-5-4-6-8-16/h4-13H,3,14H2,1-2H3<>C7H7Br/c8-6-7-4-2-1-3-5-7/h1-5H,6H2!Na.H/q1;-1<>C3H7NO/c1-4(2)3-5/h3H,1-2H3/d-. RAuxInfo=1.00.1/0/N:1,2,3,4,5,6

RInChI Example. RInChI=1.00.1S/C10H12ClN3O3/c11-10-12-8(14-1-3-15-4-2-14)7-9(13-10)17-6-5-16-7/h1-6H2<>C10H13Cl2N3O3/c11-8-7(18-6-3-16)9(14-10(12)13-8)15-1-4-17-5-2-15/h16H,1-6H2!Na.H/q1;-1<>C4H8O/c1-2-4-5-3-1/h1-4H2/d-. RAuxInfo=1.00.1/0/N:1,2,3,4,5

RInChI Example. RInChI=1.00.1S/C4H4BrNO2/c5-6-3(7)1-2-4(6)8/h1-2H2!C8H12N2/c1-5-6(2)10-8(4)7(3)9-5/h1-4H3<>C8H11BrN2/c1-5-6(2)11-8(4-9)7(3)10-5/h4H2,1-3H3/d+.

RInChI Example. RInChI=1.00.1S/C7H4BrFO2/c8-6-4(7(10)11)2-1-3-5(6)9/h1-3H,(H,10,11)!CH4O/c1-2/h2H,1H3!Cl2OS/c1-4(2)3<>C8H6BrFO2/c1-12-8(11)5-3-2-4-6(10)7(5)9/h2-4H,1H3/d+.

RInChI Example. RInChI=1.00.1S/<>C11H14N4O2/c16-15(17)10-5-4-9(14-8-10)2-1-3-11-12-6-7-13-11/h4-5,8H,1-3,6-7H2,(H,12,13)!CH4O/c1-2/h2H,1H3!K.Mn.4O/q1;;;;;-1<>C2H3N/c1-2-3/h1H3/d-.

RInChI Example. RInChI=1.00.1S/C7H8BrN5/c1-12-7(8)5(2-11-12)6-3-13(9)4-10-6/h2-4H,9H2,1H3<>C9H10BrN5O2/c1-13-8(10)6(3-12-13)7-4-15(5-11-7)14(2)9(16)17/h3-5H,1-2H3,(H,16,17)/p-1!Na.H2O/h;1H2/q1;/p-1/d-.

RInChI Example. RInChI=1.00.1S/C6H7NO/c7-4-5-2-1-3-6(5)8/h5H,1-3H2!CH3I/c1-2/h1H3!Li.H2O/h;1H2/q1;/p-1<>C7H9NO/c1-7(5-8)4-2-3-6(7)9/h2-4H2,1H3<>CH4O/c1-2/h2H,1H3!H2O/h1H2/d+. RAuxInfo=1.00.1/0/N:1,2,3,4,5,6,7,8/rA:8CCCCCCNO/rB:s1;s1;;s2s4;s3s5;t4;d6;

RInChI Example. RInChI=1.00.1S/C11H15N/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1,3-4,7-8H,2,5-6,9-10H2<>C5H11N/c1-2-4-6-5-3-1/h6H,1-5H2!C6H5Br/c7-6-4-2-1-3-5-6/h1-5H/d-.

RInChI Example. RInChI=1.00.1S/C12H13ClN4O2/c1-3-19-12(18)11-15-8(2)17(16-11)7-9-4-5-14-10(13)6-9/h4-6H,3,7H2,1-2H3<>C6H5Cl2N/c7-4-5-1-2-9-6(8)3-5/h1-3H,4H2!CH2O3.2K/c2-1(3)4;;/h(H2,2,3,4);;/q;21/p-2<>C3H7NO/c1-4(2)3-5/h3H,1-2H3!H2O/h1H2/d-. RAuxInfo

RInChI Example. RInChI=1.00.1S/<>C2H6N2.ClH/c1-2(3)4;/h1H3,(H3,3,4);1H!C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3!C9H8N4O2/c10-11-7(14)9-13-12-8(15-9)6-4-2-1-3-5-6/h1-5H,10H2,(H,11,14)/d-. RAuxInfo=1.00.1/1/N:1,2,3,4;5/E:(3,4);/rA:5CCNNCl/rB:s1;d2;s2;;/rC:

RInChI Example. RInChI=1.00.1S/<>C11H7F2NO3/c12-7-1-2-9(13)6(3-7)4-8-5-10(11(15)16)14-17-8/h1-3,5H,4H2,(H,15,16)!C8H19N/c1-6-9(7(2)3)8(4)5/h7-8H,6H2,1-5H3<>C3H7NO/c1-4(2)3-5/h3H,1-2H3/d-.

RInChI Example. RInChI=1.00.1S/C8H3BrClN3/c9-6-1-7-8(10)5(2-11)3-12-13(7)4-6/h1,3-4H!H2O4S/c1-5(2,3)4/h(H2,1,2,3,4)<>C8H5BrClN3O/c9-4-1-6-7(10)5(8(11)14)2-12-13(6)3-4/h1-3H,(H2,11,14)/d+.

RInChI Example. RInChI=1.00.1S/C7H13NO2/c1-10-8-4-2-7(6-9)3-5-8/h6-7H,2-5H2,1H3<>C8H15NO2/c1-10-7-8-3-5-9(11-2)6-4-8/h7H,3-6H2,1-2H3!ClH/h1H<>C4H8O/c1-2-4-5-3-1/h1-4H2/d-.

RInChI Example. RInChI=1.00.1S/<>C15H13ClO2S/c1-12-2-8-15(9-3-12)19(17,18)11-10-13-4-6-14(16)7-5-13/h2-11H,1H3!C2H6O/c1-2-3/h3H,2H2,1H3!C5H7NO2/c1-3-8-5(7)4-6-2/h3-4H2,1H3!Na.H/q1;-1<>C4H8O/c1-2-4-5-3-1/h1-4H2/d-.

RInChI Example. RInChI=1.00.1S/<>2K.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4)/q21;/p-2!CClF3O2S/c2-8(6,7)1(3,4)5<>C2H3N/c1-2-3/h1H3!C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3!H2O/h1H2/d-. RAuxInfo=1.00.1/<>1/N:1;2;3,4,5,6,7/E:;;(1,2,3,4)/rA:7KKO-O-OOP/rB:;;;;;s3s4s5d6;

RInChI Example. RInChI=1.00.1S/<>C6H15N/c1-6(2,3)5-7-4/h7H,5H2,1-4H3!C8H19N/c1-6-9(7(2)3)8(4)5/h7-8H,6H2,1-5H3<>C4H10O2/c1-5-3-4-6-2/h3-4H2,1-2H3!C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3/d-.

RInChI Example. RInChI=1.00.1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3!H2/h1H<>C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3<>C6H12/c1-2-4-6-5-3-1/h1-6H2/d+.