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3-propyl-1H-2-benzopyran-1-one

View entire compound with spectra: 4 MS (GC)

3-propyl-1H-2-benzopyran-1-one
SpectraBase Compound ID H7QpMzHC7dv
InChI InChI=1S/C12H12O2/c1-2-5-10-8-9-6-3-4-7-11(9)12(13)14-10/h3-4,6-8H,2,5H2,1H3
InChIKey KCWFZBFXFHXIQP-UHFFFAOYSA-N
Mol Weight 188.23 g/mol
Molecular Formula C12H12O2
Exact Mass 188.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtfNOlQprds
Name 3-propyl-1H-2-benzopyran-1-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O2
InChI InChI=1S/C12H12O2/c1-2-5-10-8-9-6-3-4-7-11(9)12(13)14-10/h3-4,6-8H,2,5H2,1H3
InChIKey KCWFZBFXFHXIQP-UHFFFAOYSA-N
Molecular Weight 188.226 g/mol
SMILES C1(OC(CCC)=Cc2c1cccc2)=O
SPLASH splash10-001r-9700000000-684e9fb4eecda0eaf385
Source of Spectrum H1-41-2594-3
Synonyms 3-propyl-2-benzopyran-1-one 3-propylisochromen-1-one 3-Propylisocoumarin
Wiley ID 757372