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(R/S)-N-Butyloxycarbonyl-(3-benzyloxy-2-chloro-4-methoxy)phenylalanine ethyl ether
SpectraBase Compound ID 9ied5qmeW9Z
InChI InChI=1S/C24H30ClNO6/c1-6-30-22(27)18(26-23(28)32-24(2,3)4)14-17-12-13-19(29-5)21(20(17)25)31-15-16-10-8-7-9-11-16/h7-13,18H,6,14-15H2,1-5H3,(H,26,28)
InChIKey VZEGVJCWHKCZBM-UHFFFAOYSA-N
Mol Weight 463.96 g/mol
Molecular Formula C24H30ClNO6
Exact Mass 463.176165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zYHErmnxUT
Name (R/S)-N-Butyloxycarbonyl-(3-benzyloxy-2-chloro-4-methoxy)phenylalanine ethyl ether
Alternate Name(s) Ethyl 3-[3-(benzyloxy)-2-chloro-4-methoxyphenyl]-2-[(tert-butoxycarbonyl)amino]propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30ClNO6
InChI InChI=1S/C24H30ClNO6/c1-6-30-22(27)18(26-23(28)32-24(2,3)4)14-17-12-13-19(29-5)21(20(17)25)31-15-16-10-8-7-9-11-16/h7-13,18H,6,14-15H2,1-5H3,(H,26,28)
InChIKey VZEGVJCWHKCZBM-UHFFFAOYSA-N
Molecular Weight 463.958 g/mol
SMILES N(C(OC(C)(C)C)=O)C(Cc1c(c(OCc2ccccc2)c(cc1)OC)Cl)C(=O)OCC
SPLASH splash10-052f-9140000000-1bd9e688aff1f406426f
Source of Spectrum QE-5-232-19
Wiley ID 843956