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 5 results

Search term: DCROVTQLKXLIHL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2174315

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H15NO3/c1-8-3-4-9(2)11(5-8)14-7-10(13(16)17)6-12(14)15/h3-5,10H,6-7H2,1-2H3,(H,16,17)
C13H15NO3233.2631725300
589999

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H15NO3/c1-8-3-4-9(2)11(5-8)14-7-10(13(16)17)6-12(14)15/h3-5,10H,6-7H2,1-2H3,(H,16,17)/t10-/m0/s1
C13H15NO3233.26313200
590000

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H15NO3/c1-8-3-4-9(2)11(5-8)14-7-10(13(16)17)6-12(14)15/h3-5,10H,6-7H2,1-2H3,(H,16,17)/t10-/m1/s1
C13H15NO3233.26312100
5661966

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H15NO3/c1-8-3-4-9(2)11(5-8)14-7-10(13(16)17)6-12(14)15/h3-5,10H,6-7H2,1-2H3,(H,16,17)/p-1/t10-/m1/s1
C13H14NO3232.25571100
5661967

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H15NO3/c1-8-3-4-9(2)11(5-8)14-7-10(13(16)17)6-12(14)15/h3-5,10H,6-7H2,1-2H3,(H,16,17)/p-1/t10-/m0/s1
C13H14NO3232.25571100

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