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3-methyl-2-phenylvaleric acid

View entire compound with spectra: 3 NMR, 4 FTIR, and 1 Raman

3-methyl-2-phenylvaleric acid
SpectraBase Compound ID 9v36ZuxdPpV
InChI InChI=1S/C12H16O2/c1-3-9(2)11(12(13)14)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3,(H,13,14)
InChIKey NQVALZRLGIRTKX-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LLuue4jTjuM
Name 3-Methyl-2-phenylvaleric acid, mixture of erythro and threo
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 247901
CAS Registry Number 7782-37-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-3-9(2)11(12(13)14)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3,(H,13,14)
InChIKey NQVALZRLGIRTKX-UHFFFAOYSA-N
Observed nucleus 1H
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_004149