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N-Butyl-4-propyl-3,4-dihydro-2H-isoquinolin-3-one

View entire compound with spectra: 1 MS (GC)

N-Butyl-4-propyl-3,4-dihydro-2H-isoquinolin-3-one
SpectraBase Compound ID 9pYOs0q9pUr
InChI InChI=1S/C16H23NO/c1-3-5-11-17-12-13-9-6-7-10-14(13)15(8-4-2)16(17)18/h6-7,9-10,15H,3-5,8,11-12H2,1-2H3
InChIKey SIKDGGGYELBOBY-UHFFFAOYSA-N
Mol Weight 245.37 g/mol
Molecular Formula C16H23NO
Exact Mass 245.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKrNLIBJvma
Name N-Butyl-4-propyl-3,4-dihydro-2H-isoquinolin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO
InChI InChI=1S/C16H23NO/c1-3-5-11-17-12-13-9-6-7-10-14(13)15(8-4-2)16(17)18/h6-7,9-10,15H,3-5,8,11-12H2,1-2H3
InChIKey SIKDGGGYELBOBY-UHFFFAOYSA-N
Molecular Weight 245.366 g/mol
SMILES C1(N(Cc2c(C1CCC)cccc2)CCCC)=O
SPLASH splash10-00rt-0920000000-d4b37e70af2ad080cfb9
Source of Spectrum D1-2002-1863-3
Synonyms 2-Butyl-4-propyl-1,4-dihydro-3(2H)-isoquinolinone
Wiley ID 1548214