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Cyclohexyl benzoate

View entire compound with spectra: 18 NMR, and 10 MS (GC)

Cyclohexyl benzoate
SpectraBase Compound ID F6zS0Blvdhc
InChI InChI=1S/C13H16O2/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2
InChIKey DQZKGSRJOUYVPL-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AF3qp6wqOXr
Name Benzoic acid, cyclohexyl ester
Alternate Name(s) benzoic acid cyclohexyl ester Cyclohexyl benzoate Hexahydrophenyl benzoate AI3-02126 EINECS 219-319-3
CAS Registry Number 2412-73-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2
InChIKey DQZKGSRJOUYVPL-UHFFFAOYSA-N
Molecular Weight 204.269 g/mol
SMILES c1cccc(c1)C(=O)OC1CCCCC1
SPLASH splash10-0ab9-3900000000-62f1e620f0be4f19eafa
Source of Spectrum E-31-2078-29
Wiley ID 1202010