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(E)-4-[6-[[(E)-4-ethoxy-1,4-dioxobut-2-enyl]amino]hexylamino]-4-oxo-2-butenoic acid ethyl ester
SpectraBase Compound ID 8SWgGUSYYPa
InChI InChI=1S/C18H28N2O6/c1-3-25-17(23)11-9-15(21)19-13-7-5-6-8-14-20-16(22)10-12-18(24)26-4-2/h9-12H,3-8,13-14H2,1-2H3,(H,19,21)(H,20,22)/b11-9+,12-10+
InChIKey WHIALWSXPMTAMW-WGDLNXRISA-N
Mol Weight 368.43 g/mol
Molecular Formula C18H28N2O6
Exact Mass 368.194737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GcpOIBMdQCj
Name (E)-4-[6-[[(E)-4-ethoxy-1,4-dioxobut-2-enyl]amino]hexylamino]-4-oxo-2-butenoic acid ethyl ester
Alternate Name(s) (E)-4-[6-[[(E)-4-ethoxy-4-keto-but-2-enoyl]amino]hexylamino]-4-keto-but-2-enoic acid ethyl ester ethyl (E)-4-[6-[[(E)-4-ethoxy-4-oxidanylidene-but-2-enoyl]amino]hexylamino]-4-oxidanylidene-but-2-enoate ethyl (E)-4-[6-[[(E)-4-ethoxy-4-oxo-but-2-enoyl]amino]hexylamino]-4-oxo-but-2-enoate
Comments Less than 3 mono-isotopic peaks
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Formula C18H28N2O6
InChI InChI=1S/C18H28N2O6/c1-3-25-17(23)11-9-15(21)19-13-7-5-6-8-14-20-16(22)10-12-18(24)26-4-2/h9-12H,3-8,13-14H2,1-2H3,(H,19,21)(H,20,22)/b11-9+,12-10+
InChIKey WHIALWSXPMTAMW-WGDLNXRISA-N
Molecular Weight 368.430 g/mol
SMILES N(C(\C=C\C(=O)OCC)=O)CCCCCCNC(\C=C\C(=O)OCC)=O
SPLASH splash10-0002-9000000000-7d9c009c5ec66a5a800b
Source of Spectrum F-51-7719-5
Wiley ID 792462