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

*Links on SpectraBase are not permalinks.
4-Pentenoic acid, 2-methyl-, pentyl ester
SpectraBase Compound ID D4ySjVVYai7
InChI InChI=1S/C11H20O2/c1-4-6-7-9-13-11(12)10(3)8-5-2/h5,10H,2,4,6-9H2,1,3H3
InChIKey SEJDYFKTCPTWBP-UHFFFAOYSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H20O2
Exact Mass 184.14633 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 AXJG8zJDrf0
Name 4-Pentenoic acid, 2-methyl-, pentyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 184.146329882 u
Formula C11H20O2
InChI InChI=1S/C11H20O2/c1-4-6-7-9-13-11(12)10(3)8-5-2/h5,10H,2,4,6-9H2,1,3H3
InChIKey SEJDYFKTCPTWBP-UHFFFAOYSA-N
Molecular Weight 184.279 g/mol
SMILES C(C(C(OCCCCC)=O)C)C=C