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L-Leucine, N-(2-chloroethoxycarbonyl)-N-methyl-, dodecyl ester

View entire compound with spectra: 1 NMR

L-Leucine, N-(2-chloroethoxycarbonyl)-N-methyl-, dodecyl ester
SpectraBase Compound ID ClMEmokopZ8
InChI InChI=1S/C22H42ClNO4/c1-5-6-7-8-9-10-11-12-13-14-16-27-21(25)20(18-19(2)3)24(4)22(26)28-17-15-23/h19-20H,5-18H2,1-4H3
InChIKey HFNLBRNKQFHPIA-UHFFFAOYSA-N
Mol Weight 420.0 g/mol
Molecular Formula C22H42ClNO4
Exact Mass 419.280237 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 72ErUXJzxHd
Name L-Leucine, N-(2-chloroethoxycarbonyl)-N-methyl-, dodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 419.280236532 u
Formula C22H42ClNO4
InChI InChI=1S/C22H42ClNO4/c1-5-6-7-8-9-10-11-12-13-14-16-27-21(25)20(18-19(2)3)24(4)22(26)28-17-15-23/h19-20H,5-18H2,1-4H3
InChIKey HFNLBRNKQFHPIA-UHFFFAOYSA-N
Molecular Weight 420.034 g/mol
SMILES CCCCCCCCCCCCOC(C(N(C(OCCCl)=O)C)CC(C)C)=O