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

*Links on SpectraBase are not permalinks.

Heptadecafluorononanoic acid, isobutyl ester

View entire compound with spectra: 1 NMR

Heptadecafluorononanoic acid, isobutyl ester
SpectraBase Compound ID 7cU3I6V28bt
InChI InChI=1S/C13H9F17O2/c1-4(2)3-32-5(31)6(14,15)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)12(26,27)13(28,29)30/h4H,3H2,1-2H3
InChIKey XSDRRINXCUUIPN-UHFFFAOYSA-N
Mol Weight 520.19 g/mol
Molecular Formula C13H9F17O2
Exact Mass 520.033108 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 IBBLK8V2EH2
Name Heptadecafluorononanoic acid, isobutyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 520.033108299 u
Formula C13H9F17O2
InChI InChI=1S/C13H9F17O2/c1-4(2)3-32-5(31)6(14,15)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)12(26,27)13(28,29)30/h4H,3H2,1-2H3
InChIKey XSDRRINXCUUIPN-UHFFFAOYSA-N
Molecular Weight 520.186 g/mol
SMILES C(C(C(C(C(OCC(C)C)=O)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F