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2-[2-Phenyl-2-[4-[(isopropxycarbonyl)methyl]phenoxy]ethyl]-4-benzyl-5-(trifluoroacetamido)oxazole
SpectraBase Compound ID 9G3EQzsMrOl
InChI InChI=1S/C31H29F3N2O5/c1-20(2)39-28(37)18-22-13-15-24(16-14-22)40-26(23-11-7-4-8-12-23)19-27-35-25(17-21-9-5-3-6-10-21)29(41-27)36-30(38)31(32,33)34/h3-16,20,26H,17-19H2,1-2H3,(H,36,38)
InChIKey UNQBWGQKAROFHM-UHFFFAOYSA-N
Mol Weight 566.58 g/mol
Molecular Formula C31H29F3N2O5
Exact Mass 566.202857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8tweTd53d1m
Name 2-[2-Phenyl-2-[4-[(isopropxycarbonyl)methyl]phenoxy]ethyl]-4-benzyl-5-(trifluoroacetamido)oxazole
CAS Registry Number 127086-79-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H29F3N2O5
InChI InChI=1S/C31H29F3N2O5/c1-20(2)39-28(37)18-22-13-15-24(16-14-22)40-26(23-11-7-4-8-12-23)19-27-35-25(17-21-9-5-3-6-10-21)29(41-27)36-30(38)31(32,33)34/h3-16,20,26H,17-19H2,1-2H3,(H,36,38)
InChIKey UNQBWGQKAROFHM-UHFFFAOYSA-N
Molecular Weight 566.577 g/mol
SMILES N(c1c(nc(o1)CC(Oc1ccc(CC(=O)OC(C)C)cc1)c1ccccc1)Cc1ccccc1)C(C(F)(F)F)=O
SPLASH splash10-001i-2293000000-39403f5795b0f9d5ce5f
Source of Spectrum C-112-7036-8
Synonyms isopropyl[4-(2-{4-benzyl-5-[(trifluoroacetyl)amino]-1,3-oxazol-2-yl}-1-phenylethoxy)phenyl]acetate
Wiley ID 1407319