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1H-Isoindol-1-one, 7-chloro-2,3,3a,4,5,6-hexahydro-2-(phenylmethyl)-, (.+-.)-
SpectraBase Compound ID 4WGPErbOvIy
InChI InChI=1S/C15H16ClNO/c16-13-8-4-7-12-10-17(15(18)14(12)13)9-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2
InChIKey PSZOWGCKHNTLLG-UHFFFAOYSA-N
Mol Weight 261.75 g/mol
Molecular Formula C15H16ClNO
Exact Mass 261.092042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CymnVvnXY3w
Name 1H-Isoindol-1-one, 7-chloro-2,3,3a,4,5,6-hexahydro-2-(phenylmethyl)-, (.+-.)-
CAS Registry Number 122457-67-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16ClNO
InChI InChI=1S/C15H16ClNO/c16-13-8-4-7-12-10-17(15(18)14(12)13)9-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2
InChIKey PSZOWGCKHNTLLG-UHFFFAOYSA-N
Molecular Weight 261.752 g/mol
SMILES C1=2C(N(Cc3ccccc3)CC1CCCC2Cl)=O
SPLASH splash10-0006-9250000000-50d8c2cfcfd976e8a398
Source of Spectrum KC-1989-1005-57
Synonyms 2-Benzyl-7-chloro-2,3,3a,4,5,6-hexahydro-1H-isoindol-1-one 8-Benzyl-5-chloro-8-azabicyclo[4.3.0]non-5-en-7-one
Wiley ID 1264790