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

*Links on SpectraBase are not permalinks.

Methyl 12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,19-heptadecafluorononadecanecarboxylate

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

Methyl 12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,19-heptadecafluorononadecanecarboxylate
SpectraBase Compound ID 19wRwd6V1Aw
InChI InChI=1S/C20H23F17O2/c1-39-12(38)10-8-6-4-2-3-5-7-9-11-13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)18(31,32)19(33,34)20(35,36)37/h2-11H2,1H3
InChIKey WFUFBORYSVIRQJ-UHFFFAOYSA-N
Mol Weight 618.37 g/mol
Molecular Formula C20H23F17O2
Exact Mass 618.142659 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 KU2hiLE5Msz
Name Methyl 12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,19-heptadecafluorononadecanecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 618.142658750 u
Formula C20H23F17O2
InChI InChI=1S/C20H23F17O2/c1-39-12(38)10-8-6-4-2-3-5-7-9-11-13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)18(31,32)19(33,34)20(35,36)37/h2-11H2,1H3
InChIKey WFUFBORYSVIRQJ-UHFFFAOYSA-N
Molecular Weight 618.375 g/mol
SMILES C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)CCCCCCCCCCC(=O)OC)(F)F)(F)F)(F)F