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1-Cyclohexen-1-ol, 3,5-dimethyl-, benzoate
SpectraBase Compound ID LTIqyj4Wa6p
InChI InChI=1S/C15H18O2/c1-11-8-12(2)10-14(9-11)17-15(16)13-6-4-3-5-7-13/h3-7,9,11-12H,8,10H2,1-2H3
InChIKey TWGIAZKUWOMYGC-UHFFFAOYSA-N
Mol Weight 230.31 g/mol
Molecular Formula C15H18O2
Exact Mass 230.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8AjmO20q8Ql
Name 1-Cyclohexen-1-ol, 3,5-dimethyl-, benzoate
Alternate Name(s) 3,5-Dimethyl-1-cyclohexen-1-yl benzoate Enol benzoate of 3,5-dimethycyclohexanone
CAS Registry Number 66049-36-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O2
InChI InChI=1S/C15H18O2/c1-11-8-12(2)10-14(9-11)17-15(16)13-6-4-3-5-7-13/h3-7,9,11-12H,8,10H2,1-2H3
InChIKey TWGIAZKUWOMYGC-UHFFFAOYSA-N
Molecular Weight 230.307 g/mol
SMILES C1(OC(=O)c2ccccc2)=CC(C)CC(C1)C
SPLASH splash10-0a4i-0900000000-7ceb62eba676db30d4ff
Source of Spectrum KC-1977-17-1897
Wiley ID 1232153