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N-Propyl-4-oxo-4H-1-benzopyran-3-carboxamide
SpectraBase Compound ID 3F346oGq3v1
InChI InChI=1S/C13H13NO3/c1-2-7-14-13(16)10-8-17-11-6-4-3-5-9(11)12(10)15/h3-6,8H,2,7H2,1H3,(H,14,16)
InChIKey BGGILXYAQOCCTB-UHFFFAOYSA-N
Mol Weight 231.25 g/mol
Molecular Formula C13H13NO3
Exact Mass 231.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2pLeRoXmhxT
Name N-Propyl-4-oxo-4H-1-benzopyran-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO3
InChI InChI=1S/C13H13NO3/c1-2-7-14-13(16)10-8-17-11-6-4-3-5-9(11)12(10)15/h3-6,8H,2,7H2,1H3,(H,14,16)
InChIKey BGGILXYAQOCCTB-UHFFFAOYSA-N
Instrument Name VG AutoSpec
Ionization Type EI
Literature Reference DOI 10.1021/jm2004267
Molecular Weight 231.251 g/mol
SMILES N(C(C1=COc2ccccc2C1=O)=O)CCC
SPLASH splash10-001i-0590000000-6e24714677dc4cc8e993
Source of Spectrum AF-54-5171-24
Wiley ID 1851893