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WOLWBOZBZRCPTQ-ZGTMWBDISA-N
SpectraBase Compound ID 1kk0c0MOAwr
InChI InChI=1S/2C48H87N2O8P/c2*1-37(2)12-10-13-40(7)44-16-17-45-43-15-14-41-36-42(18-20-47(41,8)46(43)19-21-48(44,45)9)56-34-32-54-30-28-52-26-24-51-25-27-53-29-31-55-33-35-58-59(57-23-11-22-49)50(38(3)4)39(5)6/h2*14,37-40,42-46H,10-13,15-21,23-36H2,1-9H3/t2*40-,42+,43+,44-,45+,46+,47+,48-,59?/m11/s1
InChIKey WOLWBOZBZRCPTQ-ZGTMWBDISA-N
Mol Weight 1702.4 g/mol
Molecular Formula C96H174N4O16P2
Exact Mass 1701.24001 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HRDhcgbqZQv
Name WOLWBOZBZRCPTQ-ZGTMWBDISA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C96H174N4O16P2
InChI InChI=1S/2C48H87N2O8P/c2*1-37(2)12-10-13-40(7)44-16-17-45-43-15-14-41-36-42(18-20-47(41,8)46(43)19-21-48(44,45)9)56-34-32-54-30-28-52-26-24-51-25-27-53-29-31-55-33-35-58-59(57-23-11-22-49)50(38(3)4)39(5)6/h2*14,37-40,42-46H,10-13,15-21,23-36H2,1-9H3/t2*40-,42+,43+,44-,45+,46+,47+,48-,59?/m11/s1
InChIKey WOLWBOZBZRCPTQ-ZGTMWBDISA-N
Literature Reference Author D.MUSUMECI,D.MONTESARCHIO
Literature Reference Citation MOLECULES,17,12378(2012)
Literature Reference DOI 10.3390/molecules171012378
Molecular Weight 1702.402 g/mol
Sample ID 1587
Solvent CDCl3