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

*Links on SpectraBase are not permalinks.

uwa-101, N-Heptafluorobutyryl-

View entire compound with spectra: 1 FTIR

uwa-101, N-Heptafluorobutyryl-
SpectraBase Compound ID FUJTxBq9bc9
InChI InChI=1S/C17H16F7NO3/c1-25(14(26)15(18,19)16(20,21)17(22,23)24)11(10-3-4-10)6-9-2-5-12-13(7-9)28-8-27-12/h2,5,7,10-11H,3-4,6,8H2,1H3
InChIKey WMFQJDBKBMITKQ-UHFFFAOYSA-N
Mol Weight 415.31 g/mol
Molecular Formula C17H16F7NO3
Exact Mass 415.101841 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 2ECdMFnCGLI
Name uwa-101, N-Heptafluorobutyryl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.101840517 u
Formula C17H16F7NO3
InChI InChI=1S/C17H16F7NO3/c1-25(14(26)15(18,19)16(20,21)17(22,23)24)11(10-3-4-10)6-9-2-5-12-13(7-9)28-8-27-12/h2,5,7,10-11H,3-4,6,8H2,1H3
InChIKey WMFQJDBKBMITKQ-UHFFFAOYSA-N
Molecular Weight 415.308 g/mol
SMILES C(C(N(C)C(=O)C(C(C(F)(F)F)(F)F)(F)F)C1CC1)C1=CC2=C(C=C1)OCO2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.826025