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 6 results

Search term: QPPHUXXOFJHSIQ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2023652

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H13NO5/c15-12-4-9(13(16)17)6-14(12)5-8-1-2-10-11(3-8)19-7-18-10/h1-3,9H,4-7H2,(H,16,17)
C13H13NO5263.24602544000
624825

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H13NO5/c15-12-4-9(13(16)17)6-14(12)5-8-1-2-10-11(3-8)19-7-18-10/h1-3,9H,4-7H2,(H,16,17)/t9-/m0/s1
C13H13NO5263.2462100
624826

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H13NO5/c15-12-4-9(13(16)17)6-14(12)5-8-1-2-10-11(3-8)19-7-18-10/h1-3,9H,4-7H2,(H,16,17)/t9-/m1/s1
C13H13NO5263.2462100
3274492

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H13NO5/c15-12-4-9(13(16)17)6-14(12)5-8-1-2-10-11(3-8)19-7-18-10/h1-3,9H,4-7H2,(H,16,17)/p-1
C13H12NO5262.23861100
5300859

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H13NO5/c15-12-4-9(13(16)17)6-14(12)5-8-1-2-10-11(3-8)19-7-18-10/h1-3,9H,4-7H2,(H,16,17)/p-1/t9-/m0/s1
C13H12NO5262.238081100
5300860

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H13NO5/c15-12-4-9(13(16)17)6-14(12)5-8-1-2-10-11(3-8)19-7-18-10/h1-3,9H,4-7H2,(H,16,17)/p-1/t9-/m1/s1
C13H12NO5262.238081100

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