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: UXDSNEZYZXMQEY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3256358

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C13H19NO2/c15-12-7-4-8-14(9-12)10-13(16)11-5-2-1-3-6-11/h1-3,5-6,12-13,15-16H,4,7-10H2
C13H19NO2221.2955161100
5031695

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C13H19NO2/c15-12-7-4-8-14(9-12)10-13(16)11-5-2-1-3-6-11/h1-3,5-6,12-13,15-16H,4,7-10H2/t12-,13+/m0/s1
C13H19NO2221.29552100
6319882

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C13H19NO2/c15-12-7-4-8-14(9-12)10-13(16)11-5-2-1-3-6-11/h1-3,5-6,12-13,15-16H,4,7-10H2/t12-,13-/m0/s1
C13H19NO2221.29552100
55123557

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C13H19NO2/c15-12-7-4-8-14(9-12)10-13(16)11-5-2-1-3-6-11/h1-3,5-6,12-13,15-16H,4,7-10H2/t12-,13?/m0/s1
C13H19NO2221.29552200
70682127

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C13H19NO2/c15-12-7-4-8-14(9-12)10-13(16)11-5-2-1-3-6-11/h1-3,5-6,12-13,15-16H,4,7-10H2/t12-,13?/m1/s1
C13H19NO2221.29551100
6319881

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C13H19NO2/c15-12-7-4-8-14(9-12)10-13(16)11-5-2-1-3-6-11/h1-3,5-6,12-13,15-16H,4,7-10H2/p+1/t12-,13-/m0/s1
C13H20NO2222.30291100
5031694

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C13H19NO2/c15-12-7-4-8-14(9-12)10-13(16)11-5-2-1-3-6-11/h1-3,5-6,12-13,15-16H,4,7-10H2/p+1/t12-,13+/m0/s1
C13H20NO2222.30291100

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