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Phenethyl isovalerate

View entire compound with spectra: 3 NMR, 6 FTIR, 1 Raman, and 13 MS (GC)

Phenethyl isovalerate
SpectraBase Compound ID 6sUnVTo7dqI
InChI InChI=1S/C13H18O2/c1-11(2)10-13(14)15-9-8-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3
InChIKey JIMGVOCOYZFDKB-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F45Fa0aFRwK
Name isovaleric acid, phenethyl ester
Source of Sample Givaudan-Delawanna, Inc., New York, New York
CAS Registry Number 140-26-1
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-11(2)10-13(14)15-9-8-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3
InChIKey JIMGVOCOYZFDKB-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 695M
Solvent CCl4
Synonyms PHENYLETHYL ISOVALERATE 3-METHYLBUTANOIC ACID, 2-PHENYLETHYL ESTER PHENETHYL ISOVALERATE