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(S)-4-Benzyl-2-(4-(trifluoromethyl)phenyl)-2-oxazoline

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(S)-4-Benzyl-2-(4-(trifluoromethyl)phenyl)-2-oxazoline
SpectraBase Compound ID AMM3YwhQIGL
InChI InChI=1S/C17H14F3NO/c18-17(19,20)14-8-6-13(7-9-14)16-21-15(11-22-16)10-12-4-2-1-3-5-12/h1-9,15H,10-11H2/t15-/m0/s1
InChIKey POGLGDKILGKPMJ-HNNXBMFYSA-N
Mol Weight 305.3 g/mol
Molecular Formula C17H14F3NO
Exact Mass 305.102749 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3tMCZZdY5BW
Name (S)-4-Benzyl-2-(4-(trifluoromethyl)phenyl)-2-oxazoline
Comments Computed using HOSE algorithm
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Exact Mass 305.102748563 u
Formula C17H14F3NO
InChI InChI=1S/C17H14F3NO/c18-17(19,20)14-8-6-13(7-9-14)16-21-15(11-22-16)10-12-4-2-1-3-5-12/h1-9,15H,10-11H2/t15-/m0/s1
InChIKey POGLGDKILGKPMJ-HNNXBMFYSA-N
Molecular Weight 305.300 g/mol
SMILES C=1(OC[C@@](N1)(CC=1C=CC=CC1)[H])C=1C=CC(=CC1)C(F)(F)F