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Cyclohex-3-en-1-ylmethyl 2-cyclopentylacetate

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

Cyclohex-3-en-1-ylmethyl 2-cyclopentylacetate
SpectraBase Compound ID 7wWV2uoar2L
InChI InChI=1S/C14H22O2/c15-14(10-12-6-4-5-7-12)16-11-13-8-2-1-3-9-13/h1-2,12-13H,3-11H2
InChIKey JAAGUWFQKZRQHZ-UHFFFAOYSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Hgw7g1hVdOW
Name Cyclohex-3-en-1-ylmethyl 2-cyclopentylacetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.161979946 u
Formula C14H22O2
InChI InChI=1S/C14H22O2/c15-14(10-12-6-4-5-7-12)16-11-13-8-2-1-3-9-13/h1-2,12-13H,3-11H2
InChIKey JAAGUWFQKZRQHZ-UHFFFAOYSA-N
Molecular Weight 222.328 g/mol
SMILES C(=O)(CC1CCCC1)OCC1CCC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.944514