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

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dl-Valine, N-methyl-N-(vinyloxycarbonyl)-, tetradecyl ester
SpectraBase Compound ID KhxQYddSNXQ
InChI InChI=1S/C23H43NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-28-22(25)21(20(3)4)24(5)23(26)27-7-2/h7,20-21H,2,6,8-19H2,1,3-5H3
InChIKey TXLLBCKYNVUNKP-UHFFFAOYSA-N
Mol Weight 397.6 g/mol
Molecular Formula C23H43NO4
Exact Mass 397.319209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EDy3gxR0wa7
Name dl-Valine, N-methyl-N-(vinyloxycarbonyl)-, tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 397.319208865 u
Formula C23H43NO4
InChI InChI=1S/C23H43NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-28-22(25)21(20(3)4)24(5)23(26)27-7-2/h7,20-21H,2,6,8-19H2,1,3-5H3
InChIKey TXLLBCKYNVUNKP-UHFFFAOYSA-N
Molecular Weight 397.600 g/mol
SMILES C(C(C(OCCCCCCCCCCCCCC)=O)N(C)C(=O)OC=C)(C)C