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: JVGVDSSUAVXRDY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9010

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13)
C9H10O4182.1733108114012
8096180

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13)/t8-/m0/s1
C9H10O4182.1733825500
389166

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13)/t8-/m1/s1
C9H10O4182.1733453900
7827504

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13)/p-1
C9H9O4181.16596502
7827555

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13)/p-1/t8-/m1/s1
C9H9O4181.16594400
77494348

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13)/i5D2,8D
C9H7D3O4185.19184600
98644577

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13)/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1
13C9H10O4191.10722200

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