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2-Cyanomethylcyclohexanecarboxylic acid, methyl ester

View entire compound with spectra: 2 MS (GC)

2-Cyanomethylcyclohexanecarboxylic acid, methyl ester
SpectraBase Compound ID 3IAUYNvPGGU
InChI InChI=1S/C10H15NO2/c1-13-10(12)9-5-3-2-4-8(9)6-7-11/h8-9H,2-6H2,1H3
InChIKey DDACGGOWILQTGY-UHFFFAOYSA-N
Mol Weight 181.23 g/mol
Molecular Formula C10H15NO2
Exact Mass 181.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gjl6uezxwQS
Name 2-Cyanomethylcyclohexanecarboxylic acid, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO2
InChI InChI=1S/C10H15NO2/c1-13-10(12)9-5-3-2-4-8(9)6-7-11/h8-9H,2-6H2,1H3
InChIKey DDACGGOWILQTGY-UHFFFAOYSA-N
Molecular Weight 181.235 g/mol
SMILES C(=O)(C1C(CCCC1)CC#N)OC
SPLASH splash10-001j-9500000000-9461931478b3c385f84f
Synonyms 2-(cyanomethyl)-1-cyclohexanecarboxylic acid methyl ester Methyl 2-(cyanomethyl)cyclohexane-1-carboxylate Methyl 2-(cyanomethyl)cyclohexanecarboxylate
Wiley ID 1488305