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3-(4'-hydroxybutyl)isobenzofuran-1(3H)-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(4'-hydroxybutyl)isobenzofuran-1(3H)-one
SpectraBase Compound ID 9ZnRZ8v36kh
InChI InChI=1S/C12H14O3/c13-8-4-3-7-11-9-5-1-2-6-10(9)12(14)15-11/h1-2,5-6,11,13H,3-4,7-8H2
InChIKey YGTPGNHJDMMLBH-UHFFFAOYSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DP1zhPzaOQ8
Name 3-(4'-hydroxybutyl)isobenzofuran-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c13-8-4-3-7-11-9-5-1-2-6-10(9)12(14)15-11/h1-2,5-6,11,13H,3-4,7-8H2
InChIKey YGTPGNHJDMMLBH-UHFFFAOYSA-N
Molecular Weight 206.241 g/mol
SMILES OCCCCC1OC(c2c1cccc2)=O
SPLASH splash10-001i-0900000000-d5e61ee2b438ff0eabc4
Source of Spectrum JA-49-189-0
Synonyms 3-(4-hydroxybutyl)-2-benzofuran-1(3H)-one
Wiley ID 1204464