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KDJRIWAUYKGZSP-OKOZNMEWSA-O
SpectraBase Compound ID HJ2dqtYPzhf
InChI InChI=1S/C28H33N2PS.3CO.Mo/c1-22-16-18-26(19-17-22)32-21-23(2)29-30-27(28(3,4)5)20-31(24-12-8-6-9-13-24)25-14-10-7-11-15-25;3*1-2;/h6-19H,20-21H2,1-5H3;;;;/q;;;;-1/p+1/b29-23?,30-27+;;;;
InChIKey KDJRIWAUYKGZSP-OKOZNMEWSA-O
Mol Weight 641.6 g/mol
Molecular Formula C31H34MoN2O3PS
Exact Mass 643.10818 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5gz7CDQWY8p
Name KDJRIWAUYKGZSP-OKOZNMEWSA-O
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H33MoN2O3PS
InChI InChI=1S/C28H33N2PS.3CO.Mo/c1-22-16-18-26(19-17-22)32-21-23(2)29-30-27(28(3,4)5)20-31(24-12-8-6-9-13-24)25-14-10-7-11-15-25;3*1-2;/h6-19H,20-21H2,1-5H3;;;;/q;;;;-1/p+1/b29-23?,30-27+;;;;
InChIKey KDJRIWAUYKGZSP-OKOZNMEWSA-O
Literature Reference Author S.D.PERERA,M.SHAMSUDDIN,B.L.SHAW
Literature Reference Citation CAN.J.CHEM.,73,1010(1995)
Literature Reference DOI 10.1139/v95-125
Molecular Weight 640.588 g/mol
Solvent CD2Cl2
Source File Reference UWRK995