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(S)-2-(2-oxo-1-(4-(trifluoromethyl)phenyl)cyclopentyl)acetaldehyde
SpectraBase Compound ID 6YjF0XPBsP9
InChI InChI=1S/C14H13F3O2/c15-14(16,17)11-5-3-10(4-6-11)13(8-9-18)7-1-2-12(13)19/h3-6,9H,1-2,7-8H2/t13-/m0/s1
InChIKey CFSZIPNHAPQOAY-ZDUSSCGKSA-N
Mol Weight 270.25 g/mol
Molecular Formula C14H13F3O2
Exact Mass 270.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9KVrnJxGn7t
Name (S)-2-(2-oxo-1-(4-(trifluoromethyl)phenyl)cyclopentyl)acetaldehyde
Appearance Colorless oil
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Exact Mass 270.086764146 u
Formula C14H13F3O2
InChI InChI=1S/C14H13F3O2/c15-14(16,17)11-5-3-10(4-6-11)13(8-9-18)7-1-2-12(13)19/h3-6,9H,1-2,7-8H2/t13-/m0/s1
InChIKey CFSZIPNHAPQOAY-ZDUSSCGKSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201502700
Molecular Weight 270.251 g/mol
Quality 148
Reported Formula C14H13F3O2
SMILES C1CC([C@](C1)(C1=CC=C(C=C1)C(F)(F)F)CC=O)=O
SPLASH splash10-0aos-9200000000-96bae5f1ffdff4842b95
Sample Comments 93% ee
Source of Spectrum QE-21-SM12-2e (DOI: 10.1002/chem.201502700)
Wiley ID 1907226