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

*Links on SpectraBase are not permalinks.
6-Bromohexanoic acid, undecyl ester
SpectraBase Compound ID FuAki6DJfTJ
InChI InChI=1S/C17H33BrO2/c1-2-3-4-5-6-7-8-9-13-16-20-17(19)14-11-10-12-15-18/h2-16H2,1H3
InChIKey PSMKUXWNSBWYBS-UHFFFAOYSA-N
Mol Weight 349.4 g/mol
Molecular Formula C17H33BrO2
Exact Mass 348.166393 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 TsCHUXYWx1
Name 6-Bromohexanoic acid, undecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.166393301 u
Formula C17H33BrO2
InChI InChI=1S/C17H33BrO2/c1-2-3-4-5-6-7-8-9-13-16-20-17(19)14-11-10-12-15-18/h2-16H2,1H3
InChIKey PSMKUXWNSBWYBS-UHFFFAOYSA-N
Molecular Weight 349.353 g/mol
SMILES C(CCCCCCCCCC)OC(=O)CCCCCBr