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

*Links on SpectraBase are not permalinks.

2-(2,2,4-Trimethyl-cyclopent-3-en-1-yl)propanoic acid methyl ester

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

2-(2,2,4-Trimethyl-cyclopent-3-en-1-yl)propanoic acid methyl ester
SpectraBase Compound ID 9Y9bye0SE7D
InChI InChI=1S/C12H20O2/c1-8-6-10(12(3,4)7-8)9(2)11(13)14-5/h7,9-10H,6H2,1-5H3
InChIKey IHUPFTZWWGPPTD-UHFFFAOYSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 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 HR7iUviNw3t
Name 2-(2,2,4-Trimethyl-cyclopent-3-en-1-yl)propanoic acid methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 196.146329882 u
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-8-6-10(12(3,4)7-8)9(2)11(13)14-5/h7,9-10H,6H2,1-5H3
InChIKey IHUPFTZWWGPPTD-UHFFFAOYSA-N
Molecular Weight 196.290 g/mol
SMILES C=1(CC(C(C1)(C)C)C(C(OC)=O)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.913111