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NOLBWQUSWYXGHK-SFHVURJKSA-N

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NOLBWQUSWYXGHK-SFHVURJKSA-N
SpectraBase Compound ID 4NNFu3ToVta
InChI InChI=1S/C21H31N3O6S2/c1-4-15-22(32(29,30)21-14-10-9-13-20(21)24(25)26)18(3)17-31(27,28)23(16-5-2)19-11-7-6-8-12-19/h4-5,9-10,13-14,18-19H,1-2,6-8,11-12,15-17H2,3H3/t18-/m0/s1
InChIKey NOLBWQUSWYXGHK-SFHVURJKSA-N
Mol Weight 485.61 g/mol
Molecular Formula C21H31N3O6S2
Exact Mass 485.165428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JR2IC79oxPp
Name NOLBWQUSWYXGHK-SFHVURJKSA-N
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H31N3O6S2
InChI InChI=1S/C21H31N3O6S2/c1-4-15-22(32(29,30)21-14-10-9-13-20(21)24(25)26)18(3)17-31(27,28)23(16-5-2)19-11-7-6-8-12-19/h4-5,9-10,13-14,18-19H,1-2,6-8,11-12,15-17H2,3H3/t18-/m0/s1
InChIKey NOLBWQUSWYXGHK-SFHVURJKSA-N
Literature Reference Author A.J.BROUWER,R.M.J.LISKAMP
Literature Reference Citation J.ORG.CHEM.,69,3662(2004)
Literature Reference DOI 10.1021/jo0358325
Molecular Weight 485.614 g/mol
Solvent CDCl3
Source File Reference UWVN21345