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phenyl((1R,2S)-1-phenyl-2-(trifluoromethyl)cyclohexyl)methanone
SpectraBase Compound ID mIDY2VJvGd
InChI InChI=1S/C20H19F3O/c21-20(22,23)17-13-7-8-14-19(17,16-11-5-2-6-12-16)18(24)15-9-3-1-4-10-15/h1-6,9-12,17H,7-8,13-14H2/t17-,19-/m0/s1
InChIKey ZHTGPRJUYZNZAM-HKUYNNGSSA-N
Mol Weight 332.37 g/mol
Molecular Formula C20H19F3O
Exact Mass 332.1388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ETGJDi6Gaz
Name phenyl((1R,2S)-1-phenyl-2-(trifluoromethyl)cyclohexyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19F3O
InChI InChI=1S/C20H19F3O/c21-20(22,23)17-13-7-8-14-19(17,16-11-5-2-6-12-16)18(24)15-9-3-1-4-10-15/h1-6,9-12,17H,7-8,13-14H2/t17-,19-/m0/s1
InChIKey ZHTGPRJUYZNZAM-HKUYNNGSSA-N
Literature Reference DOI 10.1002/anie.201304557
Molecular Weight 332.366 g/mol
SMILES C1CC[C@@]([C@@](C1)(C(=O)c1ccccc1)c1ccccc1)(C(F)(F)F)[H]
SPLASH splash10-0a4i-4900000000-947d5316b95ab53c5866
Source of Spectrum ACI-52-SMS11-2k
Wiley ID 1781670