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6-(2-Benzyl-1-keto-4-isoquinolyl)hexanal
SpectraBase Compound ID 6B6PFi3xz7h
InChI InChI=1S/C22H23NO2/c24-15-9-2-1-6-12-19-17-23(16-18-10-4-3-5-11-18)22(25)21-14-8-7-13-20(19)21/h3-5,7-8,10-11,13-15,17H,1-2,6,9,12,16H2
InChIKey AVKPZVYHNZJAPV-UHFFFAOYSA-N
Mol Weight 333.43 g/mol
Molecular Formula C22H23NO2
Exact Mass 333.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94GulUKHvjJ
Name 6-(2-benzyl-1-keto-4-isoquinolyl)hexanal
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO2
InChI InChI=1S/C22H23NO2/c24-15-9-2-1-6-12-19-17-23(16-18-10-4-3-5-11-18)22(25)21-14-8-7-13-20(19)21/h3-5,7-8,10-11,13-15,17H,1-2,6,9,12,16H2
InChIKey AVKPZVYHNZJAPV-UHFFFAOYSA-N
Molecular Weight 333.431 g/mol
SMILES C1(N(C=C(c2ccccc12)CCCCCC=O)Cc1ccccc1)=O
SPLASH splash10-0006-9021000000-cd179a0179deb9ac744f
Source of Spectrum SK-27-461-17
Synonyms 6-(2-benzyl-1-oxo-4-isoquinolyl)hexanal 6-(2-benzyl-1-oxoisoquinolin-4-yl)hexanal 6-[1-oxidanylidene-2-(phenylmethyl)isoquinolin-4-yl]hexanal 6-[1-oxo-2-(phenylmethyl)-4-isoquinolinyl]hexanal
Wiley ID 867587