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YBZYVRHAWKKYNO-UHFFFAOYSA-N
SpectraBase Compound ID 3YI0qmshoTk
InChI InChI=1S/C13H14O2/c1-2-3-7-11-9-10-6-4-5-8-12(10)13(14)15-11/h4-6,8-9H,2-3,7H2,1H3
InChIKey YBZYVRHAWKKYNO-UHFFFAOYSA-N
Mol Weight 202.25 g/mol
Molecular Formula C13H14O2
Exact Mass 202.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JRaW4kqdAwv
Name 3-Butylisocoumarin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O2
InChI InChI=1S/C13H14O2/c1-2-3-7-11-9-10-6-4-5-8-12(10)13(14)15-11/h4-6,8-9H,2-3,7H2,1H3
InChIKey YBZYVRHAWKKYNO-UHFFFAOYSA-N
Molecular Weight 202.253 g/mol
SMILES C1(OC(CCCC)=Cc2c1cccc2)=O
SPLASH splash10-0gb9-2930000000-3a0bbb6e9a60236723d5
Source of Spectrum J-60-3715-2
Synonyms 3-Butyl-2-benzopyran-1-one 3-Butylisochromen-1-one
Wiley ID 1200122