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: DTFPUFZXVSZQHE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
564817

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H19NO2/c1-3-6-11-7-4-5-8-13(11)16-10-12(15)9-14-2/h3-5,7-8,12,14-15H,1,6,9-10H2,2H3
C13H19NO2221.2955624900
921536

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H19NO2/c1-3-6-11-7-4-5-8-13(11)16-10-12(15)9-14-2/h3-5,7-8,12,14-15H,1,6,9-10H2,2H3/t12-/m0/s1
C13H19NO2221.29553100
921537

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H19NO2/c1-3-6-11-7-4-5-8-13(11)16-10-12(15)9-14-2/h3-5,7-8,12,14-15H,1,6,9-10H2,2H3/t12-/m1/s1
C13H19NO2221.29552100
5335504

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H19NO2/c1-3-6-11-7-4-5-8-13(11)16-10-12(15)9-14-2/h3-5,7-8,12,14-15H,1,6,9-10H2,2H3/p+1/t12-/m0/s1
C13H20NO2222.30291100
5335505

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H19NO2/c1-3-6-11-7-4-5-8-13(11)16-10-12(15)9-14-2/h3-5,7-8,12,14-15H,1,6,9-10H2,2H3/p+1/t12-/m1/s1
C13H20NO2222.30291100

Advertisement