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
Additional Filters

Found 11 results

Search term: SOFQDLYSFOWTJX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
193537

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)
C9H15NO4S233.28471621230714
8395769

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/t8-;/m0./s1
C9H15NO4S233.284791212719
34244220

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/i1D3,2D,3D,4D,5D,6D,7D2,8D;
C9H4D11NO4S244.35252200
34244221

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/i2D,3D,4D,5D,6D,7D2;
C9H8D7NO4S240.32782200
34244222

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/i1D3,7D2,8D;
C9H9D6NO4S239.32172200
34244223

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/i8D;
C9H14DNO4S234.29092200
34244224

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/i7D;
C9H14DNO4S234.29092200
34244500

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/i7D2,8D;
C9H12D3NO4S236.30322200
34985186

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/t8-;/m0./s1/i1D3;
C9H12D3NO4S236.30322300
64880410

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/i1D3;
C9H12D3NO4S236.30322200
66737653

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/t8-;/m1./s1
C9H15NO4S233.28471300

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