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 7 results

Search term: QGCAKXUASFKRJA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
390974

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H17NO/c1-7-5-12(3)6-10-8(2)11(13)4-9(7)10/h4,7-8,10H,5-6H2,1-3H3/t7-,8-,10-/m0/s1
C11H17NO179.25881719119
99581

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C11H17NO/c1-7-5-12(3)6-10-8(2)11(13)4-9(7)10/h4,7-8,10H,5-6H2,1-3H3
C11H17NO179.25888700
8210761

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H17NO/c1-7-5-12(3)6-10-8(2)11(13)4-9(7)10/h4,7-8,10H,5-6H2,1-3H3/t7-,8-,10-/m1/s1
C11H17NO179.25885400
10215275

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H17NO/c1-7-5-12(3)6-10-8(2)11(13)4-9(7)10/h4,7-8,10H,5-6H2,1-3H3/t7-,8+,10+/m0/s1
C11H17NO179.25883300
61489377

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C11H17NO/c1-7-5-12(3)6-10-8(2)11(13)4-9(7)10/h4,7-8,10H,5-6H2,1-3H3/t7-,8?,10?/m0/s1
C11H17NO179.25882200
61498657

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C11H17NO/c1-7-5-12(3)6-10-8(2)11(13)4-9(7)10/h4,7-8,10H,5-6H2,1-3H3/t7?,8-,10?/m0/s1
C11H17NO179.25882200
61627720

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C11H17NO/c1-7-5-12(3)6-10-8(2)11(13)4-9(7)10/h4,7-8,10H,5-6H2,1-3H3/t7-,8?,10+/m0/s1
C11H17NO179.25881100

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