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Cyclohexyl butyrate

View entire compound with spectra: 6 NMR, 9 FTIR, 1 Raman, and 13 MS (GC)

Cyclohexyl butyrate
SpectraBase Compound ID IwtZ2VLx4nf
InChI InChI=1S/C10H18O2/c1-2-6-10(11)12-9-7-4-3-5-8-9/h9H,2-8H2,1H3
InChIKey VZHUBBUZNIULNM-UHFFFAOYSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID sXCu8jfuRO
Name Butanoic acid, cyclohexyl ester
CAS Registry Number 1551-44-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-2-6-10(11)12-9-7-4-3-5-8-9/h9H,2-8H2,1H3
InChIKey VZHUBBUZNIULNM-UHFFFAOYSA-N
Molecular Weight 170.252 g/mol
SMILES C1CCC(OC(=O)CCC)CC1
SPLASH splash10-000x-9000000000-9a672a09b15c563057f8
Source of Spectrum IC-342-0-0
Synonyms Butyric acid, cyclohexyl ester Cyclohexanol butanoate Cyclohexanyl butyrate Cyclohexyl butanoate Cyclohexyl butyrate Cyclohexyl n-butyrate n-Butyric acid cyclohexyl ester Butanoic acid cyclohexyl ester NSC 53950
Wiley ID 1166981