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DI-[3-(4-METHYLPHENYL)-2-THIOXO-3,4-DIHYDRO-2H-1,3,2-LAMBDA(5)-BENZOXAZAPHOSPHININ-2-YL]-PHENYL-BORONATE
SpectraBase Compound ID 9CD0UZXMU3U
InChI InChI=1S/C34H31BN2O4P2S2/c1-26-16-20-31(21-17-26)36-24-28-10-6-8-14-33(28)38-42(36,44)40-35(30-12-4-3-5-13-30)41-43(45)37(32-22-18-27(2)19-23-32)25-29-11-7-9-15-34(29)39-43/h3-23H,24-25H2,1-2H3
InChIKey BDLMWISKAYTMCM-UHFFFAOYSA-N
Mol Weight 668.5 g/mol
Molecular Formula C34H31BN2O4P2S2
Exact Mass 668.129354 g/mol

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LMeWWCE5bFG
Name DI-[3-(4-METHYLPHENYL)-2-THIOXO-3,4-DIHYDRO-2H-1,3,2-LAMBDA(5)-BENZOXAZAPHOSPHININ-2-YL]-PHENYL-BORONATE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H31BN2O4P2S2
InChI InChI=1S/C34H31BN2O4P2S2/c1-26-16-20-31(21-17-26)36-24-28-10-6-8-14-33(28)38-42(36,44)40-35(30-12-4-3-5-13-30)41-43(45)37(32-22-18-27(2)19-23-32)25-29-11-7-9-15-34(29)39-43/h3-23H,24-25H2,1-2H3
InChIKey BDLMWISKAYTMCM-UHFFFAOYSA-N
Literature Reference Author K.R.KISHORE,K.REDDY,C.B.REDDY,K.S.KUMAR,C.N.RAJU,C.S.REDDY
Literature Reference Citation ORG.COMMUN.,2,28(2009)
Solvent DMSO-D6
Source File Reference UWIR13915