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(E)-2-Benzyl-3-(hex-2-enyl)isoindolin-1-one
SpectraBase Compound ID 3or7Ze4hmMa
InChI InChI=1S/C21H23NO/c1-2-3-4-8-15-20-18-13-9-10-14-19(18)21(23)22(20)16-17-11-6-5-7-12-17/h4-14,20H,2-3,15-16H2,1H3/b8-4+
InChIKey WUKQTZUYUPZOGU-XBXARRHUSA-N
Mol Weight 305.42 g/mol
Molecular Formula C21H23NO
Exact Mass 305.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 28lmaL4UHw
Name (E)-2-Benzyl-3-(hex-2-enyl)isoindolin-1-one
Appearance Colorless syrup
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO
InChI InChI=1S/C21H23NO/c1-2-3-4-8-15-20-18-13-9-10-14-19(18)21(23)22(20)16-17-11-6-5-7-12-17/h4-14,20H,2-3,15-16H2,1H3/b8-4+
InChIKey WUKQTZUYUPZOGU-XBXARRHUSA-N
Instrument Name HP 5988 A
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.21
Molecular Weight 305.421 g/mol
Reported Formula C21H23NO
SMILES c1cc2c(cc1)C(N(C2=O)Cc1ccccc1)C\C=C\CCC
SPLASH splash10-00dl-6190000000-5b16a2fd8bd764285015
Source of Spectrum BJO-8-199-4b
Wiley ID 1867307