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ZDTSTLOZWBPNGD-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR

ZDTSTLOZWBPNGD-UHFFFAOYSA-N
SpectraBase Compound ID 125N9TdbVXB
InChI InChI=1S/C60H72N15O3P7S4/c1-70(61)82(86,71(2)62)67-79(52-25-13-7-14-26-52,53-27-15-8-16-28-53)58-43-37-49(38-44-58)76-85(89,77-50-39-45-59(46-40-50)80(54-29-17-9-18-30-54,55-31-19-10-20-32-55)68-83(87,72(3)63)73(4)64)78-51-41-47-60(48-42-51)81(56-33-21-11-22-34-56,57-35-23-12-24-36-57)69-84(88,74(5)65)75(6)66/h7-48H,61-66H2,1-6H3
InChIKey ZDTSTLOZWBPNGD-UHFFFAOYSA-N
Mol Weight 1396.4 g/mol
Molecular Formula C60H72N15O3P7S4
Exact Mass 1395.298875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IqjQqVbdcZ3
Name ZDTSTLOZWBPNGD-UHFFFAOYSA-N
Compound Number G1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H72N15O3P7S4
InChI InChI=1S/C60H72N15O3P7S4/c1-70(61)82(86,71(2)62)67-79(52-25-13-7-14-26-52,53-27-15-8-16-28-53)58-43-37-49(38-44-58)76-85(89,77-50-39-45-59(46-40-50)80(54-29-17-9-18-30-54,55-31-19-10-20-32-55)68-83(87,72(3)63)73(4)64)78-51-41-47-60(48-42-51)81(56-33-21-11-22-34-56,57-35-23-12-24-36-57)69-84(88,74(5)65)75(6)66/h7-48H,61-66H2,1-6H3
InChIKey ZDTSTLOZWBPNGD-UHFFFAOYSA-N
Literature Reference Author V.MARAVAL,J.PYZOWSKI,A.M.CAMINADE,J.P.MAJORAL
Literature Reference Citation J.ORG.CHEM.,68,6043(2003)
Literature Reference DOI 10.1021/jo0344438
Molecular Weight 1396.387 g/mol
Solvent CDCl3
Source File Reference UWVN20623