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N-[1-(Ethoxycarbonyl)-2-(N-methoxymethylindol-3-yl)ethenyl]urea
SpectraBase Compound ID t4D8YFQPLb
InChI InChI=1S/C16H19N3O4/c1-3-23-15(20)13(18-16(17)21)8-11-9-19(10-22-2)14-7-5-4-6-12(11)14/h4-9H,3,10H2,1-2H3,(H3,17,18,21)/b13-8+
InChIKey AEKMNDIXAJUBPM-MDWZMJQESA-N
Mol Weight 317.35 g/mol
Molecular Formula C16H19N3O4
Exact Mass 317.137556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8gOMxxTwxo
Name N-[1-(Ethoxycarbonyl)-2-(N-methoxymethylindol-3-yl)ethenyl]urea
Alternate Name(s) ethyl (2E)-2-[(aminocarbonyl)amino]-3-[1-(methoxymethyl)-1H-indol-3-yl]-2-propenoate
Comments Less than 3 mono-isotopic peaks
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Formula C16H19N3O4
InChI InChI=1S/C16H19N3O4/c1-3-23-15(20)13(18-16(17)21)8-11-9-19(10-22-2)14-7-5-4-6-12(11)14/h4-9H,3,10H2,1-2H3,(H3,17,18,21)/b13-8+
InChIKey AEKMNDIXAJUBPM-MDWZMJQESA-N
Molecular Weight 317.345 g/mol
SMILES N(\C(=C\c1c[n](COC)c2c1cccc2)C(=O)OCC)C(=O)N
SPLASH splash10-0aor-0906000000-6cd3705e078efe740904
Source of Spectrum F-50-2251-26
Wiley ID 1317630