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cis-2-(Diphenylphosphorylmethyl)cyclohexanecarboxylic Acid
SpectraBase Compound ID nPkfXmg5p3
InChI InChI=1S/C20H23O3P/c21-20(22)19-14-8-7-9-16(19)15-24(23,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-6,10-13,16,19H,7-9,14-15H2,(H,21,22)/t16-,19-/m1/s1
InChIKey PIISHIBZOYDMNX-VQIMIIECSA-N
Mol Weight 342.37 g/mol
Molecular Formula C20H23O3P
Exact Mass 342.138482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JVasOS0M3Fa
Name cis-2-(Diphenylphosphorylmethyl)cyclohexanecarboxylic Acid
Alternate Name(s) (1R,2S)-2-[(diphenylphosphoryl)methyl]cyclohexanecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23O3P
InChI InChI=1S/C20H23O3P/c21-20(22)19-14-8-7-9-16(19)15-24(23,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-6,10-13,16,19H,7-9,14-15H2,(H,21,22)/t16-,19-/m1/s1
InChIKey PIISHIBZOYDMNX-VQIMIIECSA-N
Molecular Weight 342.375 g/mol
SMILES OC([C@]1([C@@](CP(=O)(c2ccccc2)c2ccccc2)(CCCC1)[H])[H])=O
SPLASH splash10-0uxr-1190000000-39dbf1b8c5e507df85c7
Source of Spectrum B-44-962-0
Wiley ID 1336690