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3-Butyl-4-(furan-2-ylmethyl)-1H-isochromen-1-one

View entire compound with spectra: 1 MS (GC)

3-Butyl-4-(furan-2-ylmethyl)-1H-isochromen-1-one
SpectraBase Compound ID BPx92kmkhVd
InChI InChI=1S/C18H18O3/c1-2-3-10-17-16(12-13-7-6-11-20-13)14-8-4-5-9-15(14)18(19)21-17/h4-9,11H,2-3,10,12H2,1H3
InChIKey YUAWACGAEBQFAR-UHFFFAOYSA-N
Mol Weight 282.34 g/mol
Molecular Formula C18H18O3
Exact Mass 282.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID hkQXVWC5hK
Name 3-Butyl-4-(furan-2-ylmethyl)-1H-isochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O3
InChI InChI=1S/C18H18O3/c1-2-3-10-17-16(12-13-7-6-11-20-13)14-8-4-5-9-15(14)18(19)21-17/h4-9,11H,2-3,10,12H2,1H3
InChIKey YUAWACGAEBQFAR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000044
Molecular Weight 282.339 g/mol
SMILES c1ccc2c(c1)C(OC(CCCC)=C2Cc1ccco1)=O
SPLASH splash10-001i-1690000000-65668cac962484c541c6
Source of Spectrum ASC-354-133/SM68-33
Wiley ID 1762601