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

*Links on SpectraBase are not permalinks.

7,7,7-Trifluorohept-4-yn-1-yl benzoate

View entire compound with spectra: 1 MS (GC)

7,7,7-Trifluorohept-4-yn-1-yl benzoate
SpectraBase Compound ID 70k4xUdUPA1
InChI InChI=1S/C14H13F3O2/c15-14(16,17)10-6-1-2-7-11-19-13(18)12-8-4-3-5-9-12/h3-5,8-9H,2,7,10-11H2
InChIKey JFUMBPHRMNEVTJ-UHFFFAOYSA-N
Mol Weight 270.25 g/mol
Molecular Formula C14H13F3O2
Exact Mass 270.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 2kEh2raBvli
Name 7,7,7-Trifluorohept-4-yn-1-yl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13F3O2
InChI InChI=1S/C14H13F3O2/c15-14(16,17)10-6-1-2-7-11-19-13(18)12-8-4-3-5-9-12/h3-5,8-9H,2,7,10-11H2
InChIKey JFUMBPHRMNEVTJ-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5QO00210A
Molecular Weight 270.251 g/mol
SMILES C(c1ccccc1)(=O)OCCCC#CCC(F)(F)F
SPLASH splash10-0a6r-4900000000-db9e311b26a28a000e2d
Source of Spectrum OCF-2-1385-3p
Wiley ID 1802152