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L-Norvaline, N-(2-chloroethoxycarbonyl)-, octyl ester
SpectraBase Compound ID 39WoSvRSxrS
InChI InChI=1S/C16H30ClNO4/c1-3-5-6-7-8-9-12-21-15(19)14(10-4-2)18-16(20)22-13-11-17/h14H,3-13H2,1-2H3,(H,18,20)
InChIKey GOVUJDLXRPNAAV-UHFFFAOYSA-N
Mol Weight 335.87 g/mol
Molecular Formula C16H30ClNO4
Exact Mass 335.186336 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HVUs9c4a3Ox
Name L-Norvaline, N-(2-chloroethoxycarbonyl)-, octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 335.186336146 u
Formula C16H30ClNO4
InChI InChI=1S/C16H30ClNO4/c1-3-5-6-7-8-9-12-21-15(19)14(10-4-2)18-16(20)22-13-11-17/h14H,3-13H2,1-2H3,(H,18,20)
InChIKey GOVUJDLXRPNAAV-UHFFFAOYSA-N
Molecular Weight 335.872 g/mol
SMILES CCCCCCCCOC(C(NC(OCCCl)=O)CCC)=O