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diphenyl N-(benzyloxycarbonyl)-L-alanyl-(2-decarboxy-DL-alanin-2-yl)phosphonate
SpectraBase Compound ID njqXDb4pwY
InChI InChI=1S/C25H27N2O6P/c1-19(26-20(2)27-25(29)31-18-21-12-6-3-7-13-21)24(28)34(30,32-22-14-8-4-9-15-22)33-23-16-10-5-11-17-23/h3-17,19-20,26H,18H2,1-2H3,(H,27,29)
InChIKey GWFFZOQRXNVTTR-UHFFFAOYSA-N
Mol Weight 482.47 g/mol
Molecular Formula C25H27N2O6P
Exact Mass 482.160674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID x6EhOV9hRM
Name diphenyl N-(benzyloxycarbonyl)-L-alanyl-(2-decarboxy-DL-alanin-2-yl)phosphonate
Alternate Name(s) diphenyl 2-[(1-{[(benzyloxy)carbonyl]amino}ethyl)amino]propanoylphosphonate
CAS Registry Number 126306-88-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27N2O6P
InChI InChI=1S/C25H27N2O6P/c1-19(26-20(2)27-25(29)31-18-21-12-6-3-7-13-21)24(28)34(30,32-22-14-8-4-9-15-22)33-23-16-10-5-11-17-23/h3-17,19-20,26H,18H2,1-2H3,(H,27,29)
InChIKey GWFFZOQRXNVTTR-UHFFFAOYSA-N
Molecular Weight 482.473 g/mol
SMILES N(C(C(P(Oc1ccccc1)(Oc1ccccc1)=O)=O)C)C(NC(=O)OCc1ccccc1)C
SPLASH splash10-0006-9101000000-a808adef511c2a5a2542
Source of Spectrum H-72-414-1
Wiley ID 1395583