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

*Links on SpectraBase are not permalinks.

2C-p pfp

View entire compound with spectra: 1 FTIR, and 3 MS (GC)

2C-p pfp
SpectraBase Compound ID 6rQjoh4EgSk
InChI InChI=1S/C16H20F5NO3/c1-4-5-10-8-13(25-3)11(9-12(10)24-2)6-7-22-14(23)15(17,18)16(19,20)21/h8-9H,4-7H2,1-3H3,(H,22,23)
InChIKey FRMHZRUKQQGOLO-UHFFFAOYSA-N
Mol Weight 369.33 g/mol
Molecular Formula C16H20F5NO3
Exact Mass 369.136334 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 9QHjZ5MCdwS
Name 2C-p pfp
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 369.136334320 u
Formula C16H20F5NO3
InChI InChI=1S/C16H20F5NO3/c1-4-5-10-8-13(25-3)11(9-12(10)24-2)6-7-22-14(23)15(17,18)16(19,20)21/h8-9H,4-7H2,1-3H3,(H,22,23)
InChIKey FRMHZRUKQQGOLO-UHFFFAOYSA-N
Molecular Weight 369.332 g/mol
SMILES C(C(F)(F)F)(C(NCCC1=C(C=C(C(=C1)OC)CCC)OC)=O)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.905673