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3- Phenylpropyl isobutyrate

View entire compound with spectra: 5 NMR, 6 FTIR, 1 Raman, and 6 MS (GC)

3- Phenylpropyl isobutyrate
SpectraBase Compound ID 4rHjD7utWpd
InChI InChI=1S/C13H18O2/c1-11(2)13(14)15-10-6-9-12-7-4-3-5-8-12/h3-5,7-8,11H,6,9-10H2,1-2H3
InChIKey VBTAKMZSMFMLGT-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8U3v00OwvAu
Name 3-PHENYL-1-PROPANOL, ISOBUTYRATE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Boiling Point 137C/15mm
CAS Registry Number 103-58-2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-11(2)13(14)15-10-6-9-12-7-4-3-5-8-12/h3-5,7-8,11H,6,9-10H2,1-2H3
InChIKey VBTAKMZSMFMLGT-UHFFFAOYSA-N
Molecular Weight 206.29
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 1-PROPANOL, 3-PHENYL-, ISOBUTYRATE