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

*Links on SpectraBase are not permalinks.

dl-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, octadecyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

dl-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, octadecyl ester
SpectraBase Compound ID HE3vgUmFL12
InChI InChI=1S/C29H55NO4/c1-6-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-33-28(31)27(26(3)4)30(5)29(32)34-24-9-7-2/h7,26-27H,2,6,8-25H2,1,3-5H3
InChIKey VLBCTTLUAYFKQS-UHFFFAOYSA-N
Mol Weight 481.8 g/mol
Molecular Formula C29H55NO4
Exact Mass 481.413109 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 CJdAzCpm1ib
Name dl-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, octadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 481.413109251 u
Formula C29H55NO4
InChI InChI=1S/C29H55NO4/c1-6-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-33-28(31)27(26(3)4)30(5)29(32)34-24-9-7-2/h7,26-27H,2,6,8-25H2,1,3-5H3
InChIKey VLBCTTLUAYFKQS-UHFFFAOYSA-N
Molecular Weight 481.762 g/mol
SMILES C(C(C(OCCCCCCCCCCCCCCCCCC)=O)N(C)C(=O)OCCC=C)(C)C