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IKFSVBVQMFXPJB-CRGCAULRSA-M
SpectraBase Compound ID BWKg000VZK7
InChI InChI=1S/C40H40N5O8PS.Na/c1-48-31-18-14-29(15-19-31)40(28-12-8-5-9-13-28,30-16-20-32(49-2)21-17-30)51-24-34-33(53-54(3,47)55)22-35(52-34)45-26-43-36-37(41-25-42-38(36)45)44-39(46)50-23-27-10-6-4-7-11-27;/h4-21,25-26,33-35H,22-24H2,1-3H3,(H,47,55)(H,41,42,44,46);/q;+1/p-1/t33-,34+,35+,54?;/m1./s1
InChIKey IKFSVBVQMFXPJB-CRGCAULRSA-M
Mol Weight 803.8 g/mol
Molecular Formula C40H39N5NaO8PS
Exact Mass 803.215466 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2NcFUKOqlvS
Name IKFSVBVQMFXPJB-CRGCAULRSA-M
Compound Number SLOW_RP-6-(B=A_BZ)-SODIUM_SALT
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H39N5NaO8PS
InChI InChI=1S/C40H40N5O8PS.Na/c1-48-31-18-14-29(15-19-31)40(28-12-8-5-9-13-28,30-16-20-32(49-2)21-17-30)51-24-34-33(53-54(3,47)55)22-35(52-34)45-26-43-36-37(41-25-42-38(36)45)44-39(46)50-23-27-10-6-4-7-11-27;/h4-21,25-26,33-35H,22-24H2,1-3H3,(H,47,55)(H,41,42,44,46);/q;+1/p-1/t33-,34+,35+,54?;/m1./s1
InChIKey IKFSVBVQMFXPJB-CRGCAULRSA-M
Literature Reference Author L.A.WOZNIAK,A.CHWOROS,J.PYZOWSKI,W.J.STEC
Literature Reference Citation J.ORG.CHEM.,63,9109(1998)
Literature Reference DOI 10.1021/jo981304v
Solvent DMF:C6D6
Source File Reference UWMZ27157