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Benzoic acid 1-acetyl-cyclohexyl ester
SpectraBase Compound ID 8F4C4tzjcu7
InChI InChI=1S/C15H18O3/c1-12(16)15(10-6-3-7-11-15)18-14(17)13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-11H2,1H3
InChIKey SXXIZYCQTWMXOR-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HyngVI10Y2m
Name Benzoic acid 1-acetyl-cyclohexyl ester
Alternate Name(s) 1-Acetylcyclohexyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-12(16)15(10-6-3-7-11-15)18-14(17)13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-11H2,1H3
InChIKey SXXIZYCQTWMXOR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200800355
Molecular Weight 246.306 g/mol
SMILES C(c1ccccc1)(=O)OC1(CCCCC1)C(=O)C
SPLASH splash10-0a4i-3900000000-6c7b16a47df2f734ce37
Source of Spectrum ASC-350-2414/SM19-5t
Wiley ID 1765811