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THIA-RUBIN
SpectraBase Compound ID 5aqshFme5yX
InChI InChI=1S/C34H42N4O6S/c1-7-19-21(9-3)31(43)35-27(19)15-25-17(5)23(11-13-29(39)40)33(37-25)45-34-24(12-14-30(41)42)18(6)26(38-34)16-28-20(8-2)22(10-4)32(44)36-28/h15-16,37-38H,7-14H2,1-6H3,(H,35,43)(H,36,44)(H,39,40)(H,41,42)/b27-15-,28-16-
InChIKey GFZIPJDJZNOGEL-USYBVIFISA-N
Mol Weight 634.8 g/mol
Molecular Formula C34H42N4O6S
Exact Mass 634.282506 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Me4OXajBsP
Name GFZIPJDJZNOGEL-USYBVIFISA-N
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H42N4O6S
InChI InChI=1S/C34H42N4O6S/c1-7-19-21(9-3)31(43)35-27(19)15-25-17(5)23(11-13-29(39)40)33(37-25)45-34-24(12-14-30(41)42)18(6)26(38-34)16-28-20(8-2)22(10-4)32(44)36-28/h15-16,37-38H,7-14H2,1-6H3,(H,35,43)(H,36,44)(H,39,40)(H,41,42)/b27-15-,28-16-
InChIKey GFZIPJDJZNOGEL-USYBVIFISA-N
Literature Reference Author B.GHOSH,D.A.LIGHTNER
Literature Reference Citation J.HETCYCL.CHEM.,40,1113(2003)
Literature Reference DOI 10.1002/jhet.5570400624
Molecular Weight 634.791 g/mol
Solvent Unknown
Source File Reference UWMS22968