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Ethyl 3-bromo-4-[(E)-2-(4-methoxyphenyl)ethenyl]-5-nitrobenzoate
SpectraBase Compound ID 6cZo1eLyNOc
InChI InChI=1S/C18H16BrNO5/c1-3-25-18(21)13-10-16(19)15(17(11-13)20(22)23)9-6-12-4-7-14(24-2)8-5-12/h4-11H,3H2,1-2H3/b9-6+
InChIKey DHMJOJKDOXFMPF-RMKNXTFCSA-N
Mol Weight 406.23 g/mol
Molecular Formula C18H16BrNO5
Exact Mass 405.021186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JLhdqOjrGb
Name Ethyl 3-bromo-4-[(E)-2-(4-methoxyphenyl)ethenyl]-5-nitrobenzoate
Alternate Name(s) 3-Bromo-4-[(E)-2-(4-methoxyphenyl)ethenyl]-5-nitrobenzoic acid ethyl ester 3-Bromo-4-[(E)-2-(4-methoxyphenyl)vinyl]-5-nitro-benzoic acid ethyl ester Ethyl 3-bromanyl-4-[(E)-2-(4-methoxyphenyl)ethenyl]-5-nitro-benzoate Ethyl 3-bromo-4-[(E)-2-(4-methoxyphenyl)vinyl]-5-nitro-benzoate
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Formula C18H16BrNO5
InChI InChI=1S/C18H16BrNO5/c1-3-25-18(21)13-10-16(19)15(17(11-13)20(22)23)9-6-12-4-7-14(24-2)8-5-12/h4-11H,3H2,1-2H3/b9-6+
InChIKey DHMJOJKDOXFMPF-RMKNXTFCSA-N
Molecular Weight 406.232 g/mol
SMILES C(c1cc(c(c(c1)N(=O)=O)\C=C\c1ccc(cc1)OC)Br)(=O)OCC
SPLASH splash10-000i-0900000000-d0c8406a2a8c42cddbfa
Source of Spectrum QF-9-5328-11
Wiley ID 1558946