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

*Links on SpectraBase are not permalinks.

Methyl 5-(1-cyanoethyl)-1-cyclopentenecarboxylate

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

Methyl 5-(1-cyanoethyl)-1-cyclopentenecarboxylate
SpectraBase Compound ID i262lCWWDm
InChI InChI=1S/C10H13NO2/c1-7(6-11)8-4-3-5-9(8)10(12)13-2/h5,7-8H,3-4H2,1-2H3
InChIKey FJBGFJYQNWPTQQ-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 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 Ga2M4CN55QX
Name Methyl 5-(1-cyanoethyl)-1-cyclopentenecarboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 179.094628661 u
Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-7(6-11)8-4-3-5-9(8)10(12)13-2/h5,7-8H,3-4H2,1-2H3
InChIKey FJBGFJYQNWPTQQ-UHFFFAOYSA-N
Molecular Weight 179.219 g/mol
SMILES C=1(C(=O)OC)C(C(C#N)C)CCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.808718