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

*Links on SpectraBase are not permalinks.

2-[(BENZOYLOXYCARBONYL)-AMINO]-2-[(4-METHYLPHENYL)-SULFENYL]-3,3,3-TRIFLUOROPROPANAL

Compound with spectra: 1 NMR, and 1 MS (GC)

2-[(BENZOYLOXYCARBONYL)-AMINO]-2-[(4-METHYLPHENYL)-SULFENYL]-3,3,3-TRIFLUOROPROPANAL
SpectraBase Compound ID 4XzumKCQVGP
InChI InChI=1S/C18H16F3NO3S/c1-13-7-9-15(10-8-13)26-17(12-23,18(19,20)21)22-16(24)25-11-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,22,24)/t17-/m1/s1
InChIKey AQESYUSLGHYKHF-QGZVFWFLSA-N
Mol Weight 383.39 g/mol
Molecular Formula C18H16F3NO3S
Exact Mass 383.080299 g/mol
Enantiomer InChIKey AQESYUSLGHYKHF-KRWDZBQOSA-N
Racemate InChIKey AQESYUSLGHYKHF-UHFFFAOYSA-N

View Spectrum of 2-[(BENZOYLOXYCARBONYL)-AMINO]-2-[(4-METHYLPHENYL)-SULFENYL]-3,3,3-TRIFLUOROPROPANAL

19F NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of 2-[(BENZOYLOXYCARBONYL)-AMINO]-2-[(4-METHYLPHENYL)-SULFENYL]-3,3,3-TRIFLUOROPROPANAL

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum J-62-8039-2
  • (phenylmethyl) N-[(2R)-1,1,1-tris(fluoranyl)-2-(4-methylphenyl)sulfanyl-3-oxidanylidene-propan-2-yl]carbamate
2-{N-[(Benzyloxycarbonyl)amino]}-2-(trifluoromethyl)-2-(p-tolylsulfanyl)acetaldehyde
benzyl (1S)-1-({[(1S)-2-amino-1-benzyl-2-oxoethyl]amino}carbonyl)butylcarbamate
3-[N-(Benzyloxycarbonyl)-(R)-phenylalanylamino]-5-methylhexan-2-ol
2-[(N-Cbz-N-p-tolylsulfanyl)amino]-3,3,3-trifluoropropanol
BENZYL-[(1R,4S)-4-(PHENYLSULFINYL)-CYCLOPENT-2-ENYL]-CARBAMATE
CYCLO-[PHE-ORN(CBZ)]
ZKMMNICFDNRLHK-SBXXRYSUSA-N
METHYL ALPHA-CHLORODIFLUOROMETHYL-ALPHA-PHENYLTHIOTRIFLUOROPROPANOATE
L-2-[(Benzyloxycarbonyl)amino]-4-(2-naphthyl)but-3-enoic acid
Benzyl 1-benzyl-2-[(1-benzyl-2-hydroxyethyl)amino]-2-oxoethylcarbamate
Title Journal or Book Year
(R)-Trifluoro- and Difluoropyruvaldehyde N,S-Ketals:  Chiral Synthetic Equivalents of β-Trifluoro and β-Difluoro α-Amino Aldehydes The Journal of Organic Chemistry 1998
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.