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

*Links on SpectraBase are not permalinks.

N-Octadecanoyl-L-homoserine lactone, N-pentafluoropropionyl-

View entire compound with spectra: 1 NMR

N-Octadecanoyl-L-homoserine lactone, N-pentafluoropropionyl-
SpectraBase Compound ID GIGrj5UetT4
InChI InChI=1S/C25H40F5NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(32)31(20-18-19-35-22(20)33)23(34)24(26,27)25(28,29)30/h20H,2-19H2,1H3
InChIKey IVMGPLSJHLLLAK-UHFFFAOYSA-N
Mol Weight 513.6 g/mol
Molecular Formula C25H40F5NO4
Exact Mass 513.28775 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 7PeWaRvwbzf
Name N-Octadecanoyl-L-homoserine lactone, N-pentafluoropropionyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 513.287749583 u
Formula C25H40F5NO4
InChI InChI=1S/C25H40F5NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(32)31(20-18-19-35-22(20)33)23(34)24(26,27)25(28,29)30/h20H,2-19H2,1H3
InChIKey IVMGPLSJHLLLAK-UHFFFAOYSA-N
Molecular Weight 513.590 g/mol
SMILES C1(=O)C(N(C(CCCCCCCCCCCCCCCCC)=O)C(C(C(F)(F)F)(F)F)=O)CCO1