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3a,4,5,6-tetrahydro-1-oxo-2-benzyl-4-methylisoindolin-5,6-epoxide
SpectraBase Compound ID IuQr8yjHusC
InChI InChI=1S/C16H17NO2/c1-10-13-9-17(8-11-5-3-2-4-6-11)16(18)12(13)7-14-15(10)19-14/h2-7,10,13-15H,8-9H2,1H3
InChIKey DLDGXTGRBUGCHD-UHFFFAOYSA-N
Mol Weight 255.32 g/mol
Molecular Formula C16H17NO2
Exact Mass 255.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DwyzYJU4HIb
Name 3a,4,5,6-tetrahydro-1-oxo-2-benzyl-4-methylisoindolin-5,6-epoxide
CAS Registry Number 114431-33-3
Comments Less than 3 mono-isotopic peaks
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Formula C16H17NO2
InChI InChI=1S/C16H17NO2/c1-10-13-9-17(8-11-5-3-2-4-6-11)16(18)12(13)7-14-15(10)19-14/h2-7,10,13-15H,8-9H2,1H3
InChIKey DLDGXTGRBUGCHD-UHFFFAOYSA-N
Molecular Weight 255.317 g/mol
SMILES C1=2C(N(Cc3ccccc3)CC1C(C)C1C(O1)C2)=O
SPLASH splash10-0006-9040000000-1a41cf63e5d30c555373
Source of Spectrum AJ-60-3264-2
Synonyms 4-benzyl-6-methyl-1a,4,5,5a,6,6a-hexahydro-3H-oxireno[2,3-f]isoindol-3-one
Wiley ID 1258948