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Cyclohexanepropanoic acid, methyl ester

View entire compound with spectra: 2 NMR, 2 FTIR, and 8 MS (GC)

Cyclohexanepropanoic acid, methyl ester
SpectraBase Compound ID KY0CCMaLt3C
InChI InChI=1S/C10H18O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h9H,2-8H2,1H3
InChIKey PPALFHZGSIENQB-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 2UIzXo2xTlD
Name Cyclohexanepropanoic acid, methyl ester
Alternate Name(s) Cyclohexanepropionic acid, methyl ester Methyl 3-cyclohexylpropanoate 3-cyclohexylpropanoic acid methyl ester 3-cyclohexylpropionic acid methyl ester Methyl 3-cyclohexylpropionate Methyl cyclohexane propionate AI3-14189 EINECS 243-966-0
CAS Registry Number 20681-51-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h9H,2-8H2,1H3
InChIKey PPALFHZGSIENQB-UHFFFAOYSA-N
Molecular Weight 170.252 g/mol
SMILES C(=O)(CCC1CCCCC1)OC
SPLASH splash10-0abm-9000000000-fde8228b28f5d74aef97
Wiley ID 1488997