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(1R,2S)-2-phenyl-1-cyclohexanecarboxylic acid
SpectraBase Compound ID 4FIPGABrz1b
InChI InChI=1S/C13H16O2/c14-13(15)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11-12H,4-5,8-9H2,(H,14,15)/t11-,12-/m1/s1
InChIKey BTERYDAAQMJMTD-VXGBXAGGSA-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 4WKjxjA3Yc4
Name (1R,2S)-2-phenyl-1-cyclohexanecarboxylic acid
Alternate Name(s) (1R,2S)-2-phenylcyclohexane-1-carboxylic acid
CAS Registry Number 113215-84-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c14-13(15)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11-12H,4-5,8-9H2,(H,14,15)/t11-,12-/m1/s1
InChIKey BTERYDAAQMJMTD-VXGBXAGGSA-N
Molecular Weight 204.269 g/mol
SMILES OC([C@]1([C@@](c2ccccc2)(CCCC1)[H])[H])=O
SPLASH splash10-0gb9-0910000000-8333a0d07477e5948464
Source of Spectrum J-53-2462-9
Wiley ID 1202091