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N-[O-(2-CYANOETHYL)-PHOSPHORYL]-TRYPTOPHANYL-METHYLESTER

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N-[O-(2-CYANOETHYL)-PHOSPHORYL]-TRYPTOPHANYL-METHYLESTER
SpectraBase Compound ID wqubu5LTz9
InChI InChI=1S/2C15H18N3O5P/c2*1-22-15(19)14(18-24(20,21)23-8-4-7-16)9-11-10-17-13-6-3-2-5-12(11)13/h2*2-3,5-6,10,14,17H,4,8-9H2,1H3,(H2,18,20,21)/p-2
InChIKey CHKHANLLVLECGM-UHFFFAOYSA-L
Mol Weight 700.58 g/mol
Molecular Formula C30H34N6O10P2
Exact Mass 700.181165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ki8lCiJVn03
Name N-[O-(2-CYANOETHYL)-PHOSPHORYL]-TRYPTOPHANYL-METHYLESTER
Compound Number 11H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H34N6O10P2
InChI InChI=1S/2C15H18N3O5P/c2*1-22-15(19)14(18-24(20,21)23-8-4-7-16)9-11-10-17-13-6-3-2-5-12(11)13/h2*2-3,5-6,10,14,17H,4,8-9H2,1H3,(H2,18,20,21)/p-2
InChIKey CHKHANLLVLECGM-UHFFFAOYSA-L
Literature Reference Author J.BARANIAK,R.KACZMAREK,D.KORCZYNSKI,E.WASILEWSKA
Literature Reference Citation J.ORG.CHEM.,67,7267(2002)
Literature Reference DOI 10.1021/jo026027d
Molecular Weight 700.582 g/mol
Solvent CDCl3:CD3OD
Source File Reference UWSI22265