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

*Links on SpectraBase are not permalinks.
Ethyl 2-(cyclohexylthio)pent-4-enoate
SpectraBase Compound ID 7jhj96WE4lh
InChI InChI=1S/C13H22O2S/c1-3-8-12(13(14)15-4-2)16-11-9-6-5-7-10-11/h3,11-12H,1,4-10H2,2H3
InChIKey KPYZPWNKSGUOTO-UHFFFAOYSA-N
Mol Weight 242.38 g/mol
Molecular Formula C13H22O2S
Exact Mass 242.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID FM5cdqNjKsx
Name Ethyl 2-(cyclohexylthio)pent-4-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 242.134051120 u
Formula C13H22O2S
GC Column Cyclosil-B (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 245oC
InChI InChI=1S/C13H22O2S/c1-3-8-12(13(14)15-4-2)16-11-9-6-5-7-10-11/h3,11-12H,1,4-10H2,2H3
InChIKey KPYZPWNKSGUOTO-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/anie.201607278
Molecular Weight 242.377 g/mol
Quality 43
SMILES C(C)OC(C(CC=C)SC1CCCCC1)=O
SPLASH splash10-014i-0900000000-167c6dd8b2fb2810fd2e
Source of Spectrum ACI-55-SM20-24 (DOI: 10.1002/anie.201607278)
Wiley ID 1908159