Matches any text strings used to describe a molecule.
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 429 results

Search term: C6H12N2O4S (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17344777

Charge
InChI=1/C6H11N2.H2O4S/c1-3-8-5-4-7(2)6-8;1-5(2,3)4/h4-6H,3H2,1-2H3;(H2,1,2,3,4)/q+1;/p-1
C6H12N2O4S208.2355636300
93004

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C6H12N2O4S/c7-3(5(9)10)1-13-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
C6H12N2O4S208.2355489467
11341354

Charge
InChI=1/C5H9N2.CH4O4S/c1-6-3-4-7(2)5-6;1-5-6(2,3)4/h3-5H,1-2H3;1H3,(H,2,3,4)/q+1;/p-1
C6H12N2O4S208.2355445506
88959

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H12N2O4S/c7-3(5(9)10)1-13-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)/t3-,4-/m0/s1
C6H12N2O4S208.23554310106
21926754
InChI=1/C6H12N2O4S/c7-13(11,12)8-3-1-5(2-4-8)6(9)10/h5H,1-4H2,(H,9,10)(H2,7,11,12)
C6H12N2O4S208.2355322200
28291790
InChI=1/C6H12N2O4S/c1-5(2)7-13(10,11)8-3-4-12-6(8)9/h5,7H,3-4H2,1-2H3
C6H12N2O4S208.2355282600
24013846

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H12N2O4S/c7-13(11,12)8-3-1-2-5(4-8)6(9)10/h5H,1-4H2,(H,9,10)(H2,7,11,12)
C6H12N2O4S208.2355221900
12947

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H12N2O4S/c7-3(5(9)10)1-13-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)/t3-,4+
C6H12N2O4S208.2355151700
224871

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C6H12N2O4S/c7-3(5(9)10)1-13-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)/t3-,4?/m0/s1
C6H12N2O4S208.23551317603
119099
InChI=1/C6H12N2O4S/c1-6(2,3)13-8(5(11)12)7-4(9)10/h7H,1-3H3,(H,9,10)(H,11,12)
C6H12N2O4S208.2355121000
4277710

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C6H12N2O4S/c7-8-6(10)1-4-2-13(11,12)3-5(4)9/h4-5,9H,1-3,7H2,(H,8,10)
C6H12N2O4S208.2354811700
5362945

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H12N2O4S/c7-3(5(9)10)1-13-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)/t3-,4-/m1/s1
C6H12N2O4S208.2355111000
30744208
InChI=1/C6H12N2O4S/c1-12-7-6(9)5-3-8(4-5)13(2,10)11/h5H,3-4H2,1-2H3,(H,7,9)
C6H12N2O4S208.23559700
32495793
InChI=1/C6H12N2O4S/c1-13(10,11)7-2-3-8-4-5-12-6(8)9/h7H,2-5H2,1H3
C6H12N2O4S208.23558600
166637
InChI=1/C6H12N2O4S/c9-7-8(13(10,11)12)6-4-2-1-3-5-6/h6H,1-5H2,(H,10,11,12)
C6H12N2O4S208.23558700
48226373
InChI=1/C6H12N2O4S/c7-13(10,11)5-6(9)8-1-3-12-4-2-8/h1-5H2,(H2,7,10,11)
C6H12N2O4S208.23557600
20208843
InChI=1/C6H12N2O4S/c7-5(9)1-3-13(11,12)4-2-6(8)10/h1-4H2,(H2,7,9)(H2,8,10)
C6H12N2O4S208.23557600
23364340

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H12N2O4S/c1-6(7-5(9)8-10)2-3-13(11,12)4-6/h10H,2-4H2,1H3,(H2,7,8,9)
C6H12N2O4S208.23556500
23364347

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H12N2O4S/c9-6(8-10)7-3-5-1-2-13(11,12)4-5/h5,10H,1-4H2,(H2,7,8,9)
C6H12N2O4S208.23556500
15746256

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C6H12N2O4S/c7-3(2-13)5(10)8-4(1-9)6(11)12/h3-4,9,13H,1-2,7H2,(H,8,10)(H,11,12)
C6H12N2O4S208.23556731345
12345

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