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dl-Valine, N-methyl-N-(vinyloxycarbonyl)-, pentadecyl ester

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

dl-Valine, N-methyl-N-(vinyloxycarbonyl)-, pentadecyl ester
SpectraBase Compound ID 3B5qe73B6oH
InChI InChI=1S/C24H45NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-29-23(26)22(21(3)4)25(5)24(27)28-7-2/h7,21-22H,2,6,8-20H2,1,3-5H3
InChIKey QPDGFZYPUQZUIJ-UHFFFAOYSA-N
Mol Weight 411.6 g/mol
Molecular Formula C24H45NO4
Exact Mass 411.334859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KtHnJNeylL
Name dl-Valine, N-methyl-N-(vinyloxycarbonyl)-, pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 411.334858929 u
Formula C24H45NO4
InChI InChI=1S/C24H45NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-29-23(26)22(21(3)4)25(5)24(27)28-7-2/h7,21-22H,2,6,8-20H2,1,3-5H3
InChIKey QPDGFZYPUQZUIJ-UHFFFAOYSA-N
Molecular Weight 411.627 g/mol
SMILES C(C(C(OCCCCCCCCCCCCCCC)=O)N(C)C(=O)OC=C)(C)C