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: XQYGYFPCJYWXTF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2134299

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H27NO/c1-10(2)9-13-11(3)7-6-8-12(4,5)14/h10-11,13-14H,6-9H2,1-5H3
C12H27NO201.3488815130199
5663591

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H27NO/c1-10(2)9-13-11(3)7-6-8-12(4,5)14/h10-11,13-14H,6-9H2,1-5H3/t11-/m0/s1
C12H27NO201.34892100
5663593

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H27NO/c1-10(2)9-13-11(3)7-6-8-12(4,5)14/h10-11,13-14H,6-9H2,1-5H3/t11-/m1/s1
C12H27NO201.34892100
5663592

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H27NO/c1-10(2)9-13-11(3)7-6-8-12(4,5)14/h10-11,13-14H,6-9H2,1-5H3/p+1/t11-/m1/s1
C12H28NO202.35631100
5663590

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H27NO/c1-10(2)9-13-11(3)7-6-8-12(4,5)14/h10-11,13-14H,6-9H2,1-5H3/p+1/t11-/m0/s1
C12H28NO202.35631100

Advertisement