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N-[1-(Ethoxycarbonyl)-2-(6-bromo-N-methoxymethylindol-3-yl)ethenyl]urea
SpectraBase Compound ID K6WSvDKpAkA
InChI InChI=1S/C16H18BrN3O4/c1-3-24-15(21)13(19-16(18)22)6-10-8-20(9-23-2)14-7-11(17)4-5-12(10)14/h4-8H,3,9H2,1-2H3,(H3,18,19,22)/b13-6+
InChIKey YHBIRIDETJYFFN-AWNIVKPZSA-N
Mol Weight 396.24 g/mol
Molecular Formula C16H18BrN3O4
Exact Mass 395.048069 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HrwoKe05IvW
Name N-[1-(Ethoxycarbonyl)-2-(6-bromo-N-methoxymethylindol-3-yl)ethenyl]urea
Alternate Name(s) ethyl (2E)-2-[(aminocarbonyl)amino]-3-[6-bromo-1-(methoxymethyl)-1H-indol-3-yl]-2-propenoate
Comments Less than 3 mono-isotopic peaks
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Formula C16H18BrN3O4
InChI InChI=1S/C16H18BrN3O4/c1-3-24-15(21)13(19-16(18)22)6-10-8-20(9-23-2)14-7-11(17)4-5-12(10)14/h4-8H,3,9H2,1-2H3,(H3,18,19,22)/b13-6+
InChIKey YHBIRIDETJYFFN-AWNIVKPZSA-N
Molecular Weight 396.241 g/mol
SMILES N(\C(=C\c1c[n](COC)c2c1ccc(Br)c2)C(=O)OCC)C(=O)N
SPLASH splash10-0002-9001000000-e830bf788c828868aa6e
Source of Spectrum F-50-2251-26
Wiley ID 1366963