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: BJRJHSIVXVLLHI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2050344

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H27NO2/c1-12(2)17-10-14(18)11-19-15-8-6-13(7-9-15)16(3,4)5/h6-9,12,14,17-18H,10-11H2,1-5H3
C16H27NO2265.39108181200
671680

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H27NO2/c1-12(2)17-10-14(18)11-19-15-8-6-13(7-9-15)16(3,4)5/h6-9,12,14,17-18H,10-11H2,1-5H3/t14-/m0/s1
C16H27NO2265.39113100
671682

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H27NO2/c1-12(2)17-10-14(18)11-19-15-8-6-13(7-9-15)16(3,4)5/h6-9,12,14,17-18H,10-11H2,1-5H3/t14-/m1/s1
C16H27NO2265.39112100
3929006

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H27NO2/c1-12(2)17-10-14(18)11-19-15-8-6-13(7-9-15)16(3,4)5/h6-9,12,14,17-18H,10-11H2,1-5H3/p+1
C16H28NO2266.39851100
5314247

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H27NO2/c1-12(2)17-10-14(18)11-19-15-8-6-13(7-9-15)16(3,4)5/h6-9,12,14,17-18H,10-11H2,1-5H3/p+1/t14-/m0/s1
C16H28NO2266.399021100
6337024

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H27NO2/c1-12(2)17-10-14(18)11-19-15-8-6-13(7-9-15)16(3,4)5/h6-9,12,14,17-18H,10-11H2,1-5H3/p+1/t14-/m1/s1
C16H28NO2266.39851100

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