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N-(2,4-Dimethoxybenzyl)-3,4,5-trimethoxybenzothioamide
SpectraBase Compound ID Ak24lDCPhA6
InChI InChI=1S/C19H23NO5S/c1-21-14-7-6-12(15(10-14)22-2)11-20-19(26)13-8-16(23-3)18(25-5)17(9-13)24-4/h6-10H,11H2,1-5H3,(H,20,26)
InChIKey XQUUUMZBOKTRCS-UHFFFAOYSA-N
Mol Weight 377.46 g/mol
Molecular Formula C19H23NO5S
Exact Mass 377.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hg2CftAtm7F
Name N-(2,4-Dimethoxybenzyl)-3,4,5-trimethoxybenzothioamide
Alternate Name(s) N-[(2,4-dimethoxyphenyl)methyl]-3,4,5-trimethoxybenzenecarbothioamide N-[(2,4-dimethoxyphenyl)methyl]-3,4,5-trimethoxy-benzenecarbothioamide
Comments Less than 3 mono-isotopic peaks
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Formula C19H23NO5S
InChI InChI=1S/C19H23NO5S/c1-21-14-7-6-12(15(10-14)22-2)11-20-19(26)13-8-16(23-3)18(25-5)17(9-13)24-4/h6-10H,11H2,1-5H3,(H,20,26)
InChIKey XQUUUMZBOKTRCS-UHFFFAOYSA-N
Molecular Weight 377.455 g/mol
SMILES N(C(c1cc(c(c(c1)OC)OC)OC)=S)Cc1c(cc(cc1)OC)OC
SPLASH splash10-0udi-0902000000-e685e7546dd0223b0a19
Source of Spectrum EJ-42-39-24
Wiley ID 1712064