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6-Methoxy-3,4-di-n-propylisoquinolin-1(2H)-one
SpectraBase Compound ID JqpE9HrOA5y
InChI InChI=1S/C16H21NO2/c1-4-6-12-14-10-11(19-3)8-9-13(14)16(18)17-15(12)7-5-2/h8-10H,4-7H2,1-3H3,(H,17,18)
InChIKey XLIFARLOLQLNDF-UHFFFAOYSA-N
Mol Weight 259.35 g/mol
Molecular Formula C16H21NO2
Exact Mass 259.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID M9Pt1Sd3LC
Name 6-Methoxy-3,4-di-n-propylisoquinolin-1(2H)-one
Alternate Name(s) 6-Methoxy-3,4-dipropylisoquinolin-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO2
InChI InChI=1S/C16H21NO2/c1-4-6-12-14-10-11(19-3)8-9-13(14)16(18)17-15(12)7-5-2/h8-10H,4-7H2,1-3H3,(H,17,18)
InChIKey XLIFARLOLQLNDF-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo501884v
Molecular Weight 259.349 g/mol
SMILES N1C(c2ccc(cc2C(=C1CCC)CCC)OC)=O
SPLASH splash10-001i-0090000000-43d8d98771023b741039
Source of Spectrum J-79-12078-5ca
Wiley ID 1755641