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

*Links on SpectraBase are not permalinks.

2-(1(S)-(Carbobenzyloxyamino)-3-methylbutyl)-4-benzyl-5-(N-benzyltrifluoroacetamido)oxazole

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

2-(1(S)-(Carbobenzyloxyamino)-3-methylbutyl)-4-benzyl-5-(N-benzyltrifluoroacetamido)oxazole
SpectraBase Compound ID DS0sJIHXHLh
InChI InChI=1S/C32H32F3N3O4/c1-22(2)18-26(37-31(40)41-21-25-16-10-5-11-17-25)28-36-27(19-23-12-6-3-7-13-23)29(42-28)38(30(39)32(33,34)35)20-24-14-8-4-9-15-24/h3-17,22,26H,18-21H2,1-2H3,(H,37,40)/t26-/m0/s1
InChIKey RWEFTASIJDHRFX-SANMLTNESA-N
Mol Weight 579.6 g/mol
Molecular Formula C32H32F3N3O4
Exact Mass 579.234491 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID CU4kM062eo8
Name 2-(1(S)-(Carbobenzyloxyamino)-3-methylbutyl)-4-benzyl-5-(N-benzyltrifluoroacetamido)oxazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 579.234491007 u
Formula C32H32F3N3O4
InChI InChI=1S/C32H32F3N3O4/c1-22(2)18-26(37-31(40)41-21-25-16-10-5-11-17-25)28-36-27(19-23-12-6-3-7-13-23)29(42-28)38(30(39)32(33,34)35)20-24-14-8-4-9-15-24/h3-17,22,26H,18-21H2,1-2H3,(H,37,40)/t26-/m0/s1
InChIKey RWEFTASIJDHRFX-SANMLTNESA-N
Molecular Weight 579.620 g/mol
SMILES C=1(N(C(C(F)(F)F)=O)CC=2C=CC=CC2)OC([C@@](NC(=O)OCC=2C=CC=CC2)(CC(C)C)[H])=NC1CC=1C=CC=CC1