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1-{[(2,5-dimethoxy-4-nitrophenyl)thio]acetyl}-2-(3,4,5-trimethoxybenzoyl)hydrazine
SpectraBase Compound ID 68KMAwABwtl
InChI InChI=1S/C20H23N3O9S/c1-28-13-9-17(14(29-2)8-12(13)23(26)27)33-10-18(24)21-22-20(25)11-6-15(30-3)19(32-5)16(7-11)31-4/h6-9H,10H2,1-5H3,(H,21,24)(H,22,25)
InChIKey PSFUHQHZKIBVSP-UHFFFAOYSA-N
Mol Weight 481.48 g/mol
Molecular Formula C20H23N3O9S
Exact Mass 481.1155 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4aAVGndMTXi
Name 1-{[(2,5-dimethoxy-4-nitrophenyl)thio]acetyl}-2-(3,4,5-trimethoxybenzoyl)hydrazine
Comments Computed using HOSE algorithm
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Exact Mass 481.115500498 u
Formula C20H23N3O9S
InChI InChI=1S/C20H23N3O9S/c1-28-13-9-17(14(29-2)8-12(13)23(26)27)33-10-18(24)21-22-20(25)11-6-15(30-3)19(32-5)16(7-11)31-4/h6-9H,10H2,1-5H3,(H,21,24)(H,22,25)
InChIKey PSFUHQHZKIBVSP-UHFFFAOYSA-N
Molecular Weight 481.476 g/mol
SMILES N(C(C1=CC(=C(C(=C1)OC)OC)OC)=O)NC(=O)CSC=1C=C(C(=CC1OC)N(=O)=O)OC