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Methyl 3-(hydroxymethyl)cyclohexanecarboxylate

View entire compound with spectra: 1 MS (GC)

Methyl 3-(hydroxymethyl)cyclohexanecarboxylate
SpectraBase Compound ID IhgjauoAN4x
InChI InChI=1S/C9H16O3/c1-12-9(11)8-4-2-3-7(5-8)6-10/h7-8,10H,2-6H2,1H3
InChIKey JNCPTEDQFZOIHX-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6BciO3yALSv
Name Methyl 3-(hydroxymethyl)cyclohexanecarboxylate
Alternate Name(s) 3-(hydroxymethyl)-1-cyclohexanecarboxylic acid methyl ester Methyl 3-(hydroxymethyl)cyclohexane-1-carboxylate
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Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-12-9(11)8-4-2-3-7(5-8)6-10/h7-8,10H,2-6H2,1H3
InChIKey JNCPTEDQFZOIHX-UHFFFAOYSA-N
Molecular Weight 172.224 g/mol
SMILES OCC1CC(CCC1)C(=O)OC
SPLASH splash10-001i-9100000000-0a80c6098f69cd8c0173
Source of Spectrum JX-2015-6-5321
Wiley ID 1729087