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FMHCCWJSVMNDAR-UHFFFAOYSA-N

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FMHCCWJSVMNDAR-UHFFFAOYSA-N
SpectraBase Compound ID ILseT9hSwAe
InChI InChI=1S/C38H50N6O14/c1-49-31-7-5-25(21-33(31)51-3)9-11-39-59-43-29-23-27(41-43)35(45)55-17-13-54-16-20-58-38(48)30-24-28(36(46)56-18-14-53-15-19-57-37(29)47)42-44(30)60-40-12-10-26-6-8-32(50-2)34(22-26)52-4/h5-8,21-24H,9-20,39-40H2,1-4H3
InChIKey FMHCCWJSVMNDAR-UHFFFAOYSA-N
Mol Weight 814.8 g/mol
Molecular Formula C38H50N6O14
Exact Mass 814.3385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ASSwVnj8dPk
Name FMHCCWJSVMNDAR-UHFFFAOYSA-N
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H50N6O14
InChI InChI=1S/C38H50N6O14/c1-49-31-7-5-25(21-33(31)51-3)9-11-39-59-43-29-23-27(41-43)35(45)55-17-13-54-16-20-58-38(48)30-24-28(36(46)56-18-14-53-15-19-57-37(29)47)42-44(30)60-40-12-10-26-6-8-32(50-2)34(22-26)52-4/h5-8,21-24H,9-20,39-40H2,1-4H3
InChIKey FMHCCWJSVMNDAR-UHFFFAOYSA-N
Literature Reference Author L.CAMPAYO,J.M.BUENO,P.NAVARRO,C.OCHOA,J.JIMENEZ-BARBERO,G.PE PE,A.SAMAT
Literature Reference Citation J.ORG.CHEM.,62,2684(1997)
Literature Reference DOI 10.1021/jo9623651
Molecular Weight 814.847 g/mol
Solvent DMSO-D6