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 7 results

Search term: WVQBLGZPHOPPFO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4025


0 of 1 defined stereocentres - 0/1 defined
InChI=1/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3
C15H22ClNO2283.79379645055450
9315717

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3/t12-/m0/s1
C15H22ClNO2283.7937518900
9776388

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3/t12-/m1/s1
C15H22ClNO2283.7937272700
24532769

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3/i3D3,10D2,12D
C15H16D6ClNO2289.8307111700
77494125

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3/i1D3,2D3,5D2,6D,7D,8D
C15H11D11ClNO2294.86154600
114642894

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3/t12-/m1/s1/i3D3,10D2,12D
C15H16D6ClNO2289.83072200
110406182

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3/i6+2,7+2,8+2,11+2,13+2,15+2
C914C6H22ClNO2295.74891100

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