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5-(4-Bromophenyl)-3-methoxycarbonylmethyl-2-phenylimino-3,6-dihydro-2H-1,3,4-thiadiazine
SpectraBase Compound ID 8fUUiWppvBR
InChI InChI=1S/C18H16BrN3O2S/c1-24-17(23)11-22-18(20-15-5-3-2-4-6-15)25-12-16(21-22)13-7-9-14(19)10-8-13/h2-10H,11-12H2,1H3/b20-18+
InChIKey OYLSSDJUFDDXQR-CZIZESTLSA-N
Mol Weight 418.31 g/mol
Molecular Formula C18H16BrN3O2S
Exact Mass 417.014661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AsrAmJmOgHR
Name 5-(4-Bromophenyl)-3-methoxycarbonylmethyl-2-phenylimino-3,6-dihydro-2H-1,3,4-thiadiazine
Alternate Name(s) Methyl ((2E)-5-(4-bromophenyl)-2-(phenylimino)-2H-1,3,4-thiadiazin-3(6H)-yl)acetate
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Formula C18H16BrN3O2S
InChI InChI=1S/C18H16BrN3O2S/c1-24-17(23)11-22-18(20-15-5-3-2-4-6-15)25-12-16(21-22)13-7-9-14(19)10-8-13/h2-10H,11-12H2,1H3/b20-18+
InChIKey OYLSSDJUFDDXQR-CZIZESTLSA-N
Molecular Weight 418.309 g/mol
SMILES C1S\C(N(N=C1c1ccc(cc1)Br)CC(=O)OC)=N/c1ccccc1
SPLASH splash10-001i-0900000000-ab7dd68c777b67a3325f
Source of Spectrum SO-64-519-5
Wiley ID 1540745