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(R/S)-N-Butyloxycarbonyl-(3-benzyloxy-2-chloro-4-methoxy)phenylalanine
SpectraBase Compound ID GUxbS8redMy
InChI InChI=1S/C22H26ClNO6/c1-3-4-12-29-22(27)24-17(21(25)26)13-16-10-11-18(28-2)20(19(16)23)30-14-15-8-6-5-7-9-15/h5-11,17H,3-4,12-14H2,1-2H3,(H,24,27)(H,25,26)
InChIKey VFJRTJSAVDJOBY-UHFFFAOYSA-N
Mol Weight 435.9 g/mol
Molecular Formula C22H26ClNO6
Exact Mass 435.144865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4MNPmEczaGb
Name (R/S)-N-Butyloxycarbonyl-(3-benzyloxy-2-chloro-4-methoxy)phenylalanine
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Formula C22H26ClNO6
InChI InChI=1S/C22H26ClNO6/c1-3-4-12-29-22(27)24-17(21(25)26)13-16-10-11-18(28-2)20(19(16)23)30-14-15-8-6-5-7-9-15/h5-11,17H,3-4,12-14H2,1-2H3,(H,24,27)(H,25,26)
InChIKey VFJRTJSAVDJOBY-UHFFFAOYSA-N
Molecular Weight 435.904 g/mol
SMILES N(C(=O)OCCCC)C(C(=O)O)Cc1c(c(OCc2ccccc2)c(cc1)OC)Cl
SPLASH splash10-0006-9311000000-252414baef6d6f788e2d
Source of Spectrum QE-5-232-20
Synonyms 3-(benzyloxy)-N-(butoxycarbonyl)-2-chloro-4-methoxyphenylalanine
Wiley ID 843955