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DIPROPYL-[3-(L-1-BENZYLAMINO-3,3-DIMETHYL-1-OXOBUTAN-2-YL)-THIOUREIDO]-(PHEHYL)-METHYLPHOSPHONATE
SpectraBase Compound ID JaseRpfNdtE
InChI InChI=1S/C27H40N3O4PS/c1-6-18-33-35(32,34-19-7-2)25(22-16-12-9-13-17-22)30-26(36)29-23(27(3,4)5)24(31)28-20-21-14-10-8-11-15-21/h8-17,23,25H,6-7,18-20H2,1-5H3,(H,28,31)(H2,29,30,36)/t23-,25?/m0/s1
InChIKey GFMRXMFVWVLCTO-LFQPHHBNSA-N
Mol Weight 533.7 g/mol
Molecular Formula C27H40N3O4PS
Exact Mass 533.247715 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7aWMzVeTYdc
Name DIPROPYL-[3-(L-1-BENZYLAMINO-3,3-DIMETHYL-1-OXOBUTAN-2-YL)-THIOUREIDO]-(PHEHYL)-METHYLPHOSPHONATE
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H40N3O4PS
InChI InChI=1S/C27H40N3O4PS/c1-6-18-33-35(32,34-19-7-2)25(22-16-12-9-13-17-22)30-26(36)29-23(27(3,4)5)24(31)28-20-21-14-10-8-11-15-21/h8-17,23,25H,6-7,18-20H2,1-5H3,(H,28,31)(H2,29,30,36)/t23-,25?/m0/s1
InChIKey GFMRXMFVWVLCTO-LFQPHHBNSA-N
Literature Reference Author J.LIU,A.YANG,X.LI,H.FAN,P.BHADURY,W.XU,J.WU,Z.WANG
Literature Reference Citation MOLECULES,15,5112(2010)
Literature Reference DOI 10.3390/molecules15085112
Solvent CDCl3
Source File Reference UWLU71572