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(S)-4-Allyl-4-benzyl-2-(4-(trifluoromethyl)phenyl)oxazol-5(4H)-one
SpectraBase Compound ID Lv69ubrs53g
InChI InChI=1S/C20H16F3NO2/c1-2-12-19(13-14-6-4-3-5-7-14)18(25)26-17(24-19)15-8-10-16(11-9-15)20(21,22)23/h2-11H,1,12-13H2/t19-/m0/s1
InChIKey QFUIZUOOABNDNM-IBGZPJMESA-N
Mol Weight 359.35 g/mol
Molecular Formula C20H16F3NO2
Exact Mass 359.113313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9Xy8KjER6a
Name (S)-4-Allyl-4-benzyl-2-(4-(trifluoromethyl)phenyl)oxazol-5(4H)-one
Alternate Name(s) (4S)-4-(phenylmethyl)-4-prop-2-enyl-2-[4-(trifluoromethyl)phenyl]-5-oxazolone (4S)-4-benzyl-4-prop-2-enyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-5-one (4S)-4-allyl-4-benzyl-2-[4-(trifluoromethyl)phenyl]oxazol-5-one (4S)-4-(phenylmethyl)-4-prop-2-enyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-5-one
CAS Registry Number 141041-82-9
Comments Less than 3 mono-isotopic peaks
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Formula C20H16F3NO2
InChI InChI=1S/C20H16F3NO2/c1-2-12-19(13-14-6-4-3-5-7-14)18(25)26-17(24-19)15-8-10-16(11-9-15)20(21,22)23/h2-11H,1,12-13H2/t19-/m0/s1
InChIKey QFUIZUOOABNDNM-IBGZPJMESA-N
Molecular Weight 359.348 g/mol
SMILES C1(=N[C@](C(O1)=O)(Cc1ccccc1)CC=C)c1ccc(C(F)(F)F)cc1
SPLASH splash10-0006-9000000000-080147823bf9ef27a5b2
Source of Spectrum U-1992-601-7
Wiley ID 764106