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Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
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Found 34 results

Search term: C13H21N3O7S (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4072508

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H21N3O7S/c1-6-21-9(17)7-24(19,20)12-16-15-10(22-12)8(2)14-11(18)23-13(3,4)5/h8H,6-7H2,1-5H3,(H,14,18)
C13H21N3O7S363.3867410800
4617738

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H21N3O7S/c1-6-21-9(17)7-24(19,20)12-16-15-10(22-12)8(2)14-11(18)23-13(3,4)5/h8H,6-7H2,1-5H3,(H,14,18)/t8-/m0/s1
C13H21N3O7S363.38679800
2338884

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C13H21N3O7S/c14-8(13(22)23)2-3-10(18)16(6-11(19)20)12(21)9(15)7-24-5-1-4-17/h4,8-9H,1-3,5-7,14-15H2,(H,19,20)(H,22,23)/t8-,9-/m0/s1
C13H21N3O7S363.386747600
2328201

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C11H14N2O6S.C2H7NO/c1-7(10(14)15)13-20(17,18)9-5-3-8(4-6-9)12-11(16)19-2;3-1-2-4/h3-7,13H,1-2H3,(H,12,16)(H,14,15);4H,1-3H2/t7-;/m1./s1
C13H21N3O7S363.386745400
111363

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C13H21N3O7S/c1-7(17)5-24-6-9(12(21)15-4-11(19)20)16-10(18)3-2-8(14)13(22)23/h8-9H,2-6,14H2,1H3,(H,15,21)(H,16,18)(H,19,20)(H,22,23)/t8-,9-/m0/s1
C13H21N3O7S363.38675500
53660005

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H21N3O7S/c1-8-12(10(3)23-14-8)24(20,21)15-9(2)13(19)16(5-6-22-4)7-11(17)18/h9,15H,5-7H2,1-4H3,(H,17,18)
C13H21N3O7S363.38674500
54354208

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C13H21N3O7S/c1-7-10(9(3)23-15-7)24(20,21)16-8(2)11(17)14-13(4,6-22-5)12(18)19/h8,16H,6H2,1-5H3,(H,14,17)(H,18,19)
C13H21N3O7S363.38674500
54520726

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C13H21N3O7S/c1-24(21,22)16(8-12(18)19)7-10-6-15(2-3-23-10)13(20)9-4-11(17)14-5-9/h9-10H,2-8H2,1H3,(H,14,17)(H,18,19)
C13H21N3O7S363.38674500
54664084

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C13H21N3O7S/c1-7-11(9(3)23-15-7)24(20,21)16-8(2)12(17)14-10(13(18)19)5-6-22-4/h8,10,16H,5-6H2,1-4H3,(H,14,17)(H,18,19)
C13H21N3O7S363.38674500
368941

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C13H21N3O7S/c1-5(17)20-4-8-10(21-6(2)18)11(22-7(3)19)9(14)12(23-8)24-13(15)16/h8-12H,4,14H2,1-3H3,(H3,15,16)
C13H21N3O7S363.38673200
34951154

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C13H21N3O7S/c17-12(22-10-2-1-6-14-7-5-10)11-4-3-9-8-15(11)13(18)16(9)23-24(19,20)21/h9-11,14H,1-8H2,(H,19,20,21)/t9-,10+,11+/m1/s1
C13H21N3O7S363.38673300
34951155

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C13H21N3O7S/c17-12(22-10-2-1-6-14-7-5-10)11-4-3-9-8-15(11)13(18)16(9)23-24(19,20)21/h9-11,14H,1-8H2,(H,19,20,21)/t9-,10-,11+/m1/s1
C13H21N3O7S363.38673300
34951182

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C13H21N3O7S/c17-12(22-8-9-3-5-14-6-4-9)11-2-1-10-7-15(11)13(18)16(10)23-24(19,20)21/h9-11,14H,1-8H2,(H,19,20,21)/t10?,11-/m0/s1
C13H21N3O7S363.38673300
60760048

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H21N3O7S/c1-6-21-9(17)7-24(19,20)12-16-15-10(22-12)8(2)14-11(18)23-13(3,4)5/h8H,6-7H2,1-5H3,(H-,14,18,19,20)
C13H21N3O7S363.38673200
64882430

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C13H21N3O7S/c14-8(13(22)23)2-3-10(18)16(6-11(19)20)12(21)9(15)7-24-5-1-4-17/h4,8-9H,1-3,5-7,14-15H2,(H,19,20)(H,22,23)
C13H21N3O7S363.38673300
64884799

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C13H21N3O7S/c1-7(17)5-24-6-9(12(21)15-4-11(19)20)16-10(18)3-2-8(14)13(22)23/h8-9H,2-6,14H2,1H3,(H,15,21)(H,16,18)(H,19,20)(H,22,23)
C13H21N3O7S363.38673300
58900093

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C13H21N3O7S/c17-12(22-10-2-1-6-14-7-5-10)11-4-3-9-8-15(11)13(18)16(9)23-24(19,20)21/h9-11,14H,1-8H2,(H,19,20,21)/t9-,10-,11?/m0/s1
C13H21N3O7S363.38672200
58900094

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C13H21N3O7S/c17-12(22-10-2-1-6-14-7-5-10)11-4-3-9-8-15(11)13(18)16(9)23-24(19,20)21/h9-11,14H,1-8H2,(H,19,20,21)/t9-,10+,11?/m0/s1
C13H21N3O7S363.38672200
58900621

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C13H21N3O7S/c17-12(22-8-9-3-5-14-6-4-9)11-2-1-10-7-15(11)13(18)16(10)23-24(19,20)21/h9-11,14H,1-8H2,(H,19,20,21)
C13H21N3O7S363.38672200
58904952

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C13H21N3O7S/c14-8(13(22)23)2-3-10(18)16-9(7-24-5-1-4-17)12(21)15-6-11(19)20/h4,8-9H,1-3,5-7,14H2,(H,15,21)(H,16,18)(H,19,20)(H,22,23)
C13H21N3O7S363.38672200
12

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