For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(S)-4-Benzyl-2-(4-(trifluoromethyl)phenyl)oxazol-5(4H)-one
SpectraBase Compound ID CCsCXPQFilT
InChI InChI=1S/C17H12F3NO2/c18-17(19,20)13-8-6-12(7-9-13)15-21-14(16(22)23-15)10-11-4-2-1-3-5-11/h1-9,14H,10H2/t14-/m0/s1
InChIKey KDBUKMGHSWHHEL-AWEZNQCLSA-N
Mol Weight 319.28 g/mol
Molecular Formula C17H12F3NO2
Exact Mass 319.082013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID KZweodqWTRI
Name (S)-4-Benzyl-2-(4-(trifluoromethyl)phenyl)oxazol-5(4H)-one
Alternate Name(s) (4S)-4-(phenylmethyl)-2-[4-(trifluoromethyl)phenyl]-4H-oxazol-5-one (4S)-4-benzyl-2-[4-(trifluoromethyl)phenyl]-4H-1,3-oxazol-5-one (4S)-4-benzyl-2-[4-(trifluoromethyl)phenyl]-4H-oxazol-5-one (4S)-4-(phenylmethyl)-2-[4-(trifluoromethyl)phenyl]-4H-1,3-oxazol-5-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12F3NO2
InChI InChI=1S/C17H12F3NO2/c18-17(19,20)13-8-6-12(7-9-13)15-21-14(16(22)23-15)10-11-4-2-1-3-5-11/h1-9,14H,10H2/t14-/m0/s1
InChIKey KDBUKMGHSWHHEL-AWEZNQCLSA-N
Molecular Weight 319.283 g/mol
SMILES C1(=N[C@@](Cc2ccccc2)(C(O1)=O)[H])c1ccc(C(F)(F)F)cc1
SPLASH splash10-0006-9000000000-31ec46bcf65a478d7175
Source of Spectrum QC-23-179-4c
Wiley ID 1707127