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N-Butyl-4-(2'-phenylethyl)-3,4-dihydro-2H-isoquinolin-3-one
SpectraBase Compound ID 6X7AjFkjAHy
InChI InChI=1S/C21H25NO/c1-2-3-15-22-16-18-11-7-8-12-19(18)20(21(22)23)14-13-17-9-5-4-6-10-17/h4-12,20H,2-3,13-16H2,1H3
InChIKey LPMBEJIPWOVXDG-UHFFFAOYSA-N
Mol Weight 307.44 g/mol
Molecular Formula C21H25NO
Exact Mass 307.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9VhzFfyPode
Name N-Butyl-4-(2'-phenylethyl)-3,4-dihydro-2H-isoquinolin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO
InChI InChI=1S/C21H25NO/c1-2-3-15-22-16-18-11-7-8-12-19(18)20(21(22)23)14-13-17-9-5-4-6-10-17/h4-12,20H,2-3,13-16H2,1H3
InChIKey LPMBEJIPWOVXDG-UHFFFAOYSA-N
Molecular Weight 307.437 g/mol
SMILES C1(N(Cc2c(C1CCc1ccccc1)cccc2)CCCC)=O
SPLASH splash10-0r03-4194000000-9fc4d248b84a47f863f6
Source of Spectrum D1-2002-1863-3
Synonyms 2-Butyl-4-(2-phenylethyl)-1,4-dihydro-3(2H)-isoquinolinone
Wiley ID 1548213