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

*Links on SpectraBase are not permalinks.

3C-fe pe

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

3C-fe pe
SpectraBase Compound ID 7AU0CW4Iyqc
InChI InChI=1S/C18H30FNO3/c1-5-6-7-9-20-14(2)11-15-12-16(21-3)18(23-10-8-19)17(13-15)22-4/h12-14,20H,5-11H2,1-4H3
InChIKey ABTNPAIGQRXUAR-UHFFFAOYSA-N
Mol Weight 327.44 g/mol
Molecular Formula C18H30FNO3
Exact Mass 327.220972 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 IWR0cAr2N5I
Name 3C-fe pe
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 327.220971990 u
Formula C18H30FNO3
InChI InChI=1S/C18H30FNO3/c1-5-6-7-9-20-14(2)11-15-12-16(21-3)18(23-10-8-19)17(13-15)22-4/h12-14,20H,5-11H2,1-4H3
InChIKey ABTNPAIGQRXUAR-UHFFFAOYSA-N
Molecular Weight 327.440 g/mol
SMILES C1(=C(C=C(C=C1OC)CC(NCCCCC)C)OC)OCCF
Spectrum/Structure Validation Score (Vapor Phase IR) 0.865726