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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 19 results

Search term: C19H32O6S (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8493570

Double-bond stereo

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C19H32O6S/c1-12(20)11-26(24)17-10-18(22)25-13(2)6-4-3-5-7-14-8-15(21)9-16(14)19(17)23/h5,7,12-17,19-21,23H,3-4,6,8-11H2,1-2H3/b7-5+/t12-,13-,14+,15-,16+,17+,19-,26?/m0/s1
C19H32O6S388.51884300
8493571

Double-bond stereo

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C19H32O6S/c1-12(20)11-26(24)17-10-18(22)25-13(2)6-4-3-5-7-14-8-15(21)9-16(14)19(17)23/h5,7,12-17,19-21,23H,3-4,6,8-11H2,1-2H3/b7-5+/t12-,13+,14-,15+,16-,17-,19+,26?/m1/s1
C19H32O6S388.51884300
8914367

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C19H32O6S/c1-12-5-3-2-4-6-13-7-14(21)8-16(13)19(24)17(9-18(23)25-12)26-11-15(22)10-20/h4,6,12-17,19-22,24H,2-3,5,7-11H2,1H3/b6-4+/t12-,13+,14-,15?,16+,17+,19-/m0/s1
C19H32O6S388.51884300
57514458
InChI=1/C12H24O3.C7H8O3S/c13-9-7-5-3-1-2-4-6-8-12-14-10-11-15-12;1-6-2-4-7(5-3-6)11(8,9)10/h12-13H,1-11H2;2-5H,1H3,(H,8,9,10)
C19H32O6S388.51883300
111050

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C19H30O2.H2O4S/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18;1-5(2,3)4/h3,13-17,20-21H,4-11H2,1-2H3;(H2,1,2,3,4)/t13-,14-,15-,16-,17-,18-,19-;/m0./s1
C19H32O6S388.518783300
34501315
InChI=1/C19H32O6S/c1-2-3-4-5-6-7-8-9-18-10-12-19(13-11-18)24-16-14-23-15-17-25-26(20,21)22/h10-13H,2-9,14-17H2,1H3,(H,20,21,22)
C19H32O6S388.51882200
9058888

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C19H32O6S/c1-12(20)11-26(24)17-10-18(22)25-13(2)6-4-3-5-7-14-8-15(21)9-16(14)19(17)23/h5,7,12-17,19-21,23H,3-4,6,8-11H2,1-2H3/b7-5+/t12-,13-,14+,15-,16+,17+,19-,26-/m0/s1
C19H32O6S388.51882100
9058889

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C19H32O6S/c1-17(2)13-9-10-18(12-13)14(24-16-6-4-5-11-23-16)7-8-15(19(17,18)20)25-26(3,21)22/h13-16,20H,4-12H2,1-3H3/t13-,14-,15-,16?,18+,19+/m0/s1
C19H32O6S388.51882100
9102461

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C19H32O6S/c1-12(20)11-26(24)17-10-18(22)25-13(2)6-4-3-5-7-14-8-15(21)9-16(14)19(17)23/h5,7,12-17,19-21,23H,3-4,6,8-11H2,1-2H3/b7-5+/t12-,13+,14-,15+,16-,17-,19+,26+/m1/s1
C19H32O6S388.51882100
9124347

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C19H32O6S/c1-13-6-3-2-4-7-14-10-15(21)11-16(14)19(23)17(12-18(22)25-13)26(24)9-5-8-20/h4,7,13-17,19-21,23H,2-3,5-6,8-12H2,1H3/b7-4+/t13-,14+,15-,16+,17+,19-,26-/m0/s1
C19H32O6S388.51882100
9233355

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C19H32O6S/c1-19(2)24-17-13(22-15-7-3-5-9-20-15)11-26-12-14(18(17)25-19)23-16-8-4-6-10-21-16/h13-18H,3-12H2,1-2H3/t13-,14-,15?,16?,17-,18-/m1/s1
C19H32O6S388.51882100
9276303
InChI=1/C19H32O6S/c1-17-18(16-20)4-3-5-19(17)26-15-14-25-13-12-24-11-10-23-9-8-22-7-6-21-2/h3-5,20H,6-16H2,1-2H3
C19H32O6S388.51882100
9924279

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C19H32O6S/c1-5-6-11-26(20,21)16-13(3)15-8-7-12(2)14-9-10-18(4)23-17(22-16)19(14,15)25-24-18/h12-17H,5-11H2,1-4H3/t12-,13-,14+,15+,16+,17-,18+,19-/m1/s1
C19H32O6S388.51882100
23207417

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C19H32O6S/c1-13-6-3-2-4-7-14-10-15(21)11-16(14)19(23)17(12-18(22)25-13)26(24)9-5-8-20/h4,7,13-17,19-21,23H,2-3,5-6,8-12H2,1H3/b7-4+/t13-,14+,15-,16+,17+,19-,26?/m0/s1
C19H32O6S388.51882200
32778892

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C19H32O6S/c1-12-5-3-2-4-6-13-7-14(21)8-16(13)19(24)17(9-18(23)25-12)26-11-15(22)10-20/h4,6,12-17,19-22,24H,2-3,5,7-11H2,1H3/b6-4+/t12-,13+,14-,15?,16+,17-,19-/m0/s1
C19H32O6S388.51881100
58817817

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C19H30O2.H2O4S/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18;1-5(2,3)4/h3,13-17,20-21H,4-11H2,1-2H3;(H2,1,2,3,4)/t13-,14-,15-,16-,17-,18-,19?;/m0./s1
C19H32O6S388.51881100
74033623

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C19H32O6S/c1-3-22-18(21)15-26-17(14-25-16(2)20)10-6-4-5-8-12-23-19-11-7-9-13-24-19/h5,8,17,19H,3-4,6-7,9-15H2,1-2H3/b8-5+
C19H32O6S388.51881100
74103550

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C19H32O6S/c1-5-6-11-26(20,21)16-13(3)15-8-7-12(2)14-9-10-18(4)23-17(22-16)19(14,15)25-24-18/h12-17H,5-11H2,1-4H3/t12-,13-,14+,15+,16+,17-,18-,19-/m1/s1
C19H32O6S388.51881100
74103551

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C19H32O6S/c1-5-6-11-26(20,21)16-13(3)15-8-7-12(2)14-9-10-18(4)23-17(22-16)19(14,15)25-24-18/h12-17H,5-11H2,1-4H3/t12-,13-,14+,15+,16-,17-,18-,19-/m1/s1
C19H32O6S388.51881100

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