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XMSKXIBRURDAQL-LBPRGKRZSA-N
SpectraBase Compound ID FAqfNckmz3M
InChI InChI=1S/C15H23N3O6S2/c1-12(11-25(21,22)17-13-7-3-2-4-8-13)16-26(23,24)15-10-6-5-9-14(15)18(19)20/h5-6,9-10,12-13,16-17H,2-4,7-8,11H2,1H3/t12-/m0/s1
InChIKey XMSKXIBRURDAQL-LBPRGKRZSA-N
Mol Weight 405.48 g/mol
Molecular Formula C15H23N3O6S2
Exact Mass 405.102828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BhL2IIFTDdz
Name XMSKXIBRURDAQL-LBPRGKRZSA-N
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H23N3O6S2
InChI InChI=1S/C15H23N3O6S2/c1-12(11-25(21,22)17-13-7-3-2-4-8-13)16-26(23,24)15-10-6-5-9-14(15)18(19)20/h5-6,9-10,12-13,16-17H,2-4,7-8,11H2,1H3/t12-/m0/s1
InChIKey XMSKXIBRURDAQL-LBPRGKRZSA-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 405.484 g/mol
Solvent CDCl3
Source File Reference UWVN21341