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uwa-101, N-Pentafluoropropionyl-

View entire compound with spectra: 1 FTIR

uwa-101, N-Pentafluoropropionyl-
SpectraBase Compound ID G4JSuGQqLag
InChI InChI=1S/C16H16F5NO3/c1-22(14(23)15(17,18)16(19,20)21)11(10-3-4-10)6-9-2-5-12-13(7-9)25-8-24-12/h2,5,7,10-11H,3-4,6,8H2,1H3
InChIKey OSHHBQFBFKEZFP-UHFFFAOYSA-N
Mol Weight 365.3 g/mol
Molecular Formula C16H16F5NO3
Exact Mass 365.105034 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GUQmGth5zYh
Name uwa-101, N-Pentafluoropropionyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 365.105034191 u
Formula C16H16F5NO3
InChI InChI=1S/C16H16F5NO3/c1-22(14(23)15(17,18)16(19,20)21)11(10-3-4-10)6-9-2-5-12-13(7-9)25-8-24-12/h2,5,7,10-11H,3-4,6,8H2,1H3
InChIKey OSHHBQFBFKEZFP-UHFFFAOYSA-N
Molecular Weight 365.300 g/mol
SMILES C(C(N(C)C(C(C(F)(F)F)(F)F)=O)C1CC1)C1=CC2=C(C=C1)OCO2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.842593