For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-(4-Hydroxy-n-butyl)-8-methyl-3-phenyl-1H-isochromen-1-one

View entire compound with spectra: 1 MS (GC)

4-(4-Hydroxy-n-butyl)-8-methyl-3-phenyl-1H-isochromen-1-one
SpectraBase Compound ID 4y3xRZg4JIi
InChI InChI=1S/C20H20O3/c1-14-8-7-12-16-17(11-5-6-13-21)19(23-20(22)18(14)16)15-9-3-2-4-10-15/h2-4,7-10,12,21H,5-6,11,13H2,1H3
InChIKey KYVNDCGSERQEDY-UHFFFAOYSA-N
Mol Weight 308.38 g/mol
Molecular Formula C20H20O3
Exact Mass 308.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 90uccou24Nz
Name 4-(4-Hydroxy-n-butyl)-8-methyl-3-phenyl-1H-isochromen-1-one
Alternate Name(s) 4-(4-hydroxybutyl)-8-methyl-3-phenyl-1H-isochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O3
InChI InChI=1S/C20H20O3/c1-14-8-7-12-16-17(11-5-6-13-21)19(23-20(22)18(14)16)15-9-3-2-4-10-15/h2-4,7-10,12,21H,5-6,11,13H2,1H3
InChIKey KYVNDCGSERQEDY-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201500600
Molecular Weight 308.377 g/mol
SMILES OCCCCC=1c2cccc(c2C(OC1c1ccccc1)=O)C
SPLASH splash10-0adj-1494000000-bf59337c62949996af1e
Source of Spectrum ACI-54-5513/SMS33-3ah
Wiley ID 1761151