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: NCXUNZWLEYGQAH (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
34412

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C5H13NO/c1-5(7)4-6(2)3/h5,7H,4H2,1-3H3
C5H13NO103.162811212833
5323194

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H13NO/c1-5(7)4-6(2)3/h5,7H,4H2,1-3H3/t5-/m0/s1
C5H13NO103.16282564100
5414313

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H13NO/c1-5(7)4-6(2)3/h5,7H,4H2,1-3H3/t5-/m1/s1
C5H13NO103.1628292400
48061373

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H13NO/c1-5(7)4-6(2)3/h5,7H,4H2,1-3H3/i2D3,3D3
C5H7D6NO109.199871100
5414312

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H13NO/c1-5(7)4-6(2)3/h5,7H,4H2,1-3H3/p+1/t5-/m1/s1
C5H14NO104.17021100
5323193

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H13NO/c1-5(7)4-6(2)3/h5,7H,4H2,1-3H3/p+1/t5-/m0/s1
C5H14NO104.170761100

Advertisement