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2-[BOC-NH-L-TRYPTOPHANAMIDO-(2-ETHOXY)]-ETHYL-(PARA-CHLOROPHENYL)-PHOSPHATE
SpectraBase Compound ID IseXdrnuwaq
InChI InChI=1S/C26H33ClN3O8P/c1-26(2,3)37-25(32)30-23(16-18-17-29-22-7-5-4-6-21(18)22)24(31)28-12-13-35-14-15-36-39(33,34)38-20-10-8-19(27)9-11-20/h4-11,17,23,29H,12-16H2,1-3H3,(H,28,31)(H,30,32)(H,33,34)/t23-/m0/s1
InChIKey MDLCKKQHTKMTIQ-QHCPKHFHSA-N
Mol Weight 582.0 g/mol
Molecular Formula C26H33ClN3O8P
Exact Mass 581.16938 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3iws3Dpm2BU
Name 2-[BOC-NH-L-TRYPTOPHANAMIDO-(2-ETHOXY)]-ETHYL-(PARA-CHLOROPHENYL)-PHOSPHATE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H32ClN3O8P
InChI InChI=1S/C26H33ClN3O8P/c1-26(2,3)37-25(32)30-23(16-18-17-29-22-7-5-4-6-21(18)22)24(31)28-12-13-35-14-15-36-39(33,34)38-20-10-8-19(27)9-11-20/h4-11,17,23,29H,12-16H2,1-3H3,(H,28,31)(H,30,32)(H,33,34)/t23-/m0/s1
InChIKey MDLCKKQHTKMTIQ-QHCPKHFHSA-N
Literature Reference Author T.V.ABRAMOVA,O.B.MOROZOVA,V.N.SILNIKOV,A.V.YURKOVSKAYA
Literature Reference Citation BEIL.J.ORG.CHEM.,9,2898(2013)
Literature Reference DOI 10.3762/bjoc.9.326
Solvent D2O:CD3OD
Source File Reference UWLU77945