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: QOISWWBTZMFUEL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5305788

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H19NO2/c1-13(2,3)16-12(15)11(14)9-10-7-5-4-6-8-10/h4-8,11H,9,14H2,1-3H3/t11-/m0/s1
C13H19NO2221.29546614700
230756

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H19NO2/c1-13(2,3)16-12(15)11(14)9-10-7-5-4-6-8-10/h4-8,11H,9,14H2,1-3H3
C13H19NO2221.2955423900
9260507

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H19NO2/c1-13(2,3)16-12(15)11(14)9-10-7-5-4-6-8-10/h4-8,11H,9,14H2,1-3H3/t11-/m1/s1
C13H19NO2221.2955251700
48060365

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C13H19NO2/c1-13(2,3)16-12(15)11(14)9-10-7-5-4-6-8-10/h4-8,11H,9,14H2,1-3H3/t11-/m0/s1/i4D,5D,6D,7D,8D
C13H14D5NO2226.32633200
107443029

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C13H19NO2/c1-13(2,3)16-12(15)11(14)9-10-7-5-4-6-8-10/h4-8,11H,9,14H2,1-3H3/t11-/m1/s1/i4D,5D,6D,7D,8D
C13H14D5NO2226.32631400
5305787

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H19NO2/c1-13(2,3)16-12(15)11(14)9-10-7-5-4-6-8-10/h4-8,11H,9,14H2,1-3H3/p+1/t11-/m0/s1
C13H20NO2222.30341100

Advertisement