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(E)-2-nitro-4-hexenoic acid ethyl ester
SpectraBase Compound ID AIa6wqtnymS
InChI InChI=1S/C8H13NO4/c1-3-5-6-7(9(11)12)8(10)13-4-2/h3,5,7H,4,6H2,1-2H3/b5-3+
InChIKey ILULEYGDMBIXSS-HWKANZROSA-N
Mol Weight 187.19 g/mol
Molecular Formula C8H13NO4
Exact Mass 187.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DGx1MEkjR93
Name (E)-2-nitro-4-hexenoic acid ethyl ester
Alternate Name(s) (E)-2-nitrohex-4-enoic acid ethyl ester Acetic acid, 2-(2-buten-1-yl)-2-nitro-, ethyl ester Ethyl (4E)-2-nitro-4-hexenoate Ethyl (E)-2-nitrohex-4-enoate
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Formula C8H13NO4
InChI InChI=1S/C8H13NO4/c1-3-5-6-7(9(11)12)8(10)13-4-2/h3,5,7H,4,6H2,1-2H3/b5-3+
InChIKey ILULEYGDMBIXSS-HWKANZROSA-N
Molecular Weight 187.195 g/mol
SMILES C(\C=C\C)C(N(=O)=O)C(=O)OCC
SPLASH splash10-004i-9100000000-f571d65618093c3e8609
Wiley ID 1495662