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 10 results

Search term: ZZGMTCKULVMTDB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
25930

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H17NO2/c1-9(13(3)10(2)14)12(15)11-7-5-4-6-8-11/h4-9,12,15H,1-3H3
C12H17NO2207.2689243200
4953849

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO2/c1-9(13(3)10(2)14)12(15)11-7-5-4-6-8-11/h4-9,12,15H,1-3H3/t9-,12-/m0/s1
C12H17NO2207.2689151500
9519727

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO2/c1-9(13(3)10(2)14)12(15)11-7-5-4-6-8-11/h4-9,12,15H,1-3H3/t9-,12+/m0/s1
C12H17NO2207.2689122300
48059160

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO2/c1-9(13(3)10(2)14)12(15)11-7-5-4-6-8-11/h4-9,12,15H,1-3H3/t9-,12-/m1/s1
C12H17NO2207.2689101400
48057639

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C12H17NO2/c1-9(13(3)10(2)14)12(15)11-7-5-4-6-8-11/h4-9,12,15H,1-3H3/t9-,12-/m1/s1/i2D3
C12H14D3NO2210.28746700
9381613

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO2/c1-9(13(3)10(2)14)12(15)11-7-5-4-6-8-11/h4-9,12,15H,1-3H3/t9-,12+/m1/s1
C12H17NO2207.26894300
58782080

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C12H17NO2/c1-9(13(3)10(2)14)12(15)11-7-5-4-6-8-11/h4-9,12,15H,1-3H3/t9-,12+/m0/s1/i3D3
C12H14D3NO2210.28742200
71354338

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C12H17NO2/c1-9(13(3)10(2)14)12(15)11-7-5-4-6-8-11/h4-9,12,15H,1-3H3/t9-,12?/m0/s1
C12H17NO2207.26892600
107442197

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C12H17NO2/c1-9(13(3)10(2)14)12(15)11-7-5-4-6-8-11/h4-9,12,15H,1-3H3/t9-,12?/m1/s1
C12H17NO2207.26891800
111314568

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C12H17NO2/c1-9(13(3)10(2)14)12(15)11-7-5-4-6-8-11/h4-9,12,15H,1-3H3/t9-,12-/m0/s1/i2D3
C12H14D3NO2210.28741100

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