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

*Links on SpectraBase are not permalinks.

Acifluorfen, dodecyl ester

View entire compound with spectra: 1 NMR

Acifluorfen, dodecyl ester
SpectraBase Compound ID D9sJ9WJMGpu
InChI InChI=1S/C26H31ClF3NO5/c1-2-3-4-5-6-7-8-9-10-11-16-35-25(32)21-18-20(13-14-23(21)31(33)34)36-24-15-12-19(17-22(24)27)26(28,29)30/h12-15,17-18H,2-11,16H2,1H3
InChIKey VRASPOILRCZLKZ-UHFFFAOYSA-N
Mol Weight 529.98 g/mol
Molecular Formula C26H31ClF3NO5
Exact Mass 529.184285 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID Ear9MTupFbW
Name Acifluorfen, dodecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 529.184285286 u
Formula C26H31ClF3NO5
InChI InChI=1S/C26H31ClF3NO5/c1-2-3-4-5-6-7-8-9-10-11-16-35-25(32)21-18-20(13-14-23(21)31(33)34)36-24-15-12-19(17-22(24)27)26(28,29)30/h12-15,17-18H,2-11,16H2,1H3
InChIKey VRASPOILRCZLKZ-UHFFFAOYSA-N
Molecular Weight 529.984 g/mol
SMILES C1(=CC=C(C(=C1)Cl)OC=1C=CC(=C(C(OCCCCCCCCCCCC)=O)C1)N(=O)=O)C(F)(F)F