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1-(4"'-Bromobenzylidene)-4-[2'-(3",4"-dimethoxyphenyl)ethyl]-3-thiosemicarbazide
SpectraBase Compound ID Lw09WsYBOBh
InChI InChI=1S/C18H20BrN3O2S/c1-23-16-8-5-13(11-17(16)24-2)9-10-20-18(25)22-21-12-14-3-6-15(19)7-4-14/h3-8,11-12H,9-10H2,1-2H3,(H2,20,22,25)/b21-12+
InChIKey QTLIKVOGYMOBSV-CIAFOILYSA-N
Mol Weight 422.34 g/mol
Molecular Formula C18H20BrN3O2S
Exact Mass 421.045961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQV7CFJZo0m
Name 1-(4"'-Bromobenzylidene)-4-[2'-(3",4"-dimethoxyphenyl)ethyl]-3-thiosemicarbazide
Alternate Name(s) 1-[(p-Bromophenyl)benzylidene]-4-[2'-(3'',4'-dimethoxyphenyl)ethyl]-3-semicarbazide 2-(4-bromobenzylidene)-N-(3,4-dimethoxyphenethyl)hydrazinecarbothioamide 4-Bromobenzaldehyde N-[2-(3,4-dimethoxyphenyl)ethyl]thiosemicarbazone (E)-2-(4-bromobenzylidene)-N-(3,4-dimethoxyphenethyl)hydrazinecarbothioamide
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Formula C18H20BrN3O2S
InChI InChI=1S/C18H20BrN3O2S/c1-23-16-8-5-13(11-17(16)24-2)9-10-20-18(25)22-21-12-14-3-6-15(19)7-4-14/h3-8,11-12H,9-10H2,1-2H3,(H2,20,22,25)/b21-12+
InChIKey QTLIKVOGYMOBSV-CIAFOILYSA-N
Literature Reference DOI 10.1002_(SICI)1521-4184(199910)332_10_343
Molecular Weight 422.341 g/mol
SMILES N(CCc1cc(OC)c(cc1)OC)C(N\N=C\c1ccc(cc1)Br)=S
SPLASH splash10-0hua-1910200000-8f5bb4dad1ec29874eca
Source of Spectrum APP-332-346-3a
Wiley ID 1770288