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Butyric acid, 4-phenoxy-

View entire compound with spectra: 1 NMR, 1 FTIR, and 5 MS (GC)

Butyric acid, 4-phenoxy-
SpectraBase Compound ID 35l86k8SYNA
InChI InChI=1S/C10H12O3/c11-10(12)7-4-8-13-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)
InChIKey YKYVPFIBWVQZCE-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CYhWwVc6lvg
Name 4-phenoxybutanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 180.078644243 u
Formula C10H12O3
InChI InChI=1S/C10H12O3/c11-10(12)7-4-8-13-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)
InChIKey YKYVPFIBWVQZCE-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.201711531
Molecular Weight 180.203 g/mol
Quality 438
SMILES OC(CCCOC=1C=CC=CC1)=O
SPLASH splash10-0006-9000000000-43ed0dccb094eeb237a5
Source of Spectrum ACI-57-SM19-Figure S2-2 (DOI: 10.1002/anie.201711531)
Wiley ID 1890611