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: NWLNPDFDAPBKDB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2994173

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H14O4/c13-12(14)9-3-5-10(6-4-9)16-8-11-2-1-7-15-11/h3-6,11H,1-2,7-8H2,(H,13,14)
C12H14O4222.23716734500
1793863

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H14O4/c13-12(14)9-3-5-10(6-4-9)16-8-11-2-1-7-15-11/h3-6,11H,1-2,7-8H2,(H,13,14)/t11-/m1/s1
C12H14O4222.23724100
1793866

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H14O4/c13-12(14)9-3-5-10(6-4-9)16-8-11-2-1-7-15-11/h3-6,11H,1-2,7-8H2,(H,13,14)/t11-/m0/s1
C12H14O4222.23724100
1793862

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H14O4/c13-12(14)9-3-5-10(6-4-9)16-8-11-2-1-7-15-11/h3-6,11H,1-2,7-8H2,(H,13,14)/p-1/t11-/m1/s1
C12H13O4221.22981100
1793865

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H14O4/c13-12(14)9-3-5-10(6-4-9)16-8-11-2-1-7-15-11/h3-6,11H,1-2,7-8H2,(H,13,14)/p-1/t11-/m0/s1
C12H13O4221.22981100

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