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

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

dl-Valine, N-methyl-N-(vinyloxycarbonyl)-, heptadecyl ester
SpectraBase Compound ID 3OwZO0xoZKv
InChI InChI=1S/C26H49NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-31-25(28)24(23(3)4)27(5)26(29)30-7-2/h7,23-24H,2,6,8-22H2,1,3-5H3
InChIKey CUFIGGNDHUDYOP-UHFFFAOYSA-N
Mol Weight 439.7 g/mol
Molecular Formula C26H49NO4
Exact Mass 439.366159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DypOFSFH2Hf
Name dl-Valine, N-methyl-N-(vinyloxycarbonyl)-, heptadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 439.366159058 u
Formula C26H49NO4
InChI InChI=1S/C26H49NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-31-25(28)24(23(3)4)27(5)26(29)30-7-2/h7,23-24H,2,6,8-22H2,1,3-5H3
InChIKey CUFIGGNDHUDYOP-UHFFFAOYSA-N
Molecular Weight 439.681 g/mol
SMILES C(C(C(OCCCCCCCCCCCCCCCCC)=O)N(C)C(=O)OC=C)(C)C