For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Prop-2-enyl (2S)-2-methyl-3-phenylpropionate

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

Prop-2-enyl (2S)-2-methyl-3-phenylpropionate
SpectraBase Compound ID Y3b5Fp0exx
InChI InChI=1S/C13H16O2/c1-10(2)15-13(14)11(3)9-12-7-5-4-6-8-12/h4-8,11H,1,9H2,2-3H3/t11-/m0/s1
InChIKey CHYFKWQEHPXRJX-NSHDSACASA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1bNnwimo5Ib
Name Prop-2-enyl (2S)-2-methyl-3-phenylpropionate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 204.115029753 u
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-10(2)15-13(14)11(3)9-12-7-5-4-6-8-12/h4-8,11H,1,9H2,2-3H3/t11-/m0/s1
InChIKey CHYFKWQEHPXRJX-NSHDSACASA-N
Molecular Weight 204.269 g/mol
SMILES C(OC(=C)C)([C@](CC1=CC=CC=C1)(C)[H])=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.935442