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(R)-3-CAPRYLOYLOXY-4-[N,N-BIS-(2-CHLOROETHYL)-AMINO]-BUTYRIC-ACID
SpectraBase Compound ID 3mtQiD5Ym9E
InChI InChI=1S/C16H29Cl2NO4/c1-2-3-4-5-6-7-16(22)23-14(12-15(20)21)13-19(10-8-17)11-9-18/h14H,2-13H2,1H3,(H,20,21)/t14-/m1/s1
InChIKey ONLDUCDBNYPKDL-CQSZACIVSA-N
Mol Weight 370.32 g/mol
Molecular Formula C16H29Cl2NO4
Exact Mass 369.147364 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5c6ItueuyEJ
Name (R)-3-CAPRYLOYLOXY-4-[N,N-BIS-(2-CHLOROETHYL)-AMINO]-BUTYRIC-ACID
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H29Cl2NO4
InChI InChI=1S/C16H29Cl2NO4/c1-2-3-4-5-6-7-16(22)23-14(12-15(20)21)13-19(10-8-17)11-9-18/h14H,2-13H2,1H3,(H,20,21)/t14-/m1/s1
InChIKey ONLDUCDBNYPKDL-CQSZACIVSA-N
Literature Reference Author L.FAISSAT,K.MARTIN,C.CHAVIS,J.L.MONTERO,M.LUCAS
Literature Reference Citation BIOORG.MED.CHEM.,11,325(2003)
Literature Reference DOI 10.1016/S0968-0896(02)00458-3
Molecular Weight 370.317 g/mol
Sample ID 38485
Solvent CDCl3