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N-Isobutyl 3-(p-nitrophenyl)-(2E)-propenoic acid amide
SpectraBase Compound ID CgWwbvmnbhI
InChI InChI=1S/C13H16N2O3/c1-10(2)9-14-13(16)8-5-11-3-6-12(7-4-11)15(17)18/h3-8,10H,9H2,1-2H3,(H,14,16)/b8-5+
InChIKey SLIFMMDBQDQWRS-VMPITWQZSA-N
Mol Weight 248.28 g/mol
Molecular Formula C13H16N2O3
Exact Mass 248.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5AX9PNgrDhI
Name N-Isobutyl 3-(p-nitrophenyl)-(2E)-propenoic acid amide
Alternate Name(s) (E)-N-isobutyl-3-(4-nitrophenyl)acrylamide
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Formula C13H16N2O3
InChI InChI=1S/C13H16N2O3/c1-10(2)9-14-13(16)8-5-11-3-6-12(7-4-11)15(17)18/h3-8,10H,9H2,1-2H3,(H,14,16)/b8-5+
InChIKey SLIFMMDBQDQWRS-VMPITWQZSA-N
Literature Reference DOI 10.1002/hc.520010309
Molecular Weight 248.282 g/mol
SMILES N(C(\C=C\c1ccc(cc1)[N+](=O)[O-])=O)CC(C)C
SPLASH splash10-004i-0950000000-8971e6365849e4e2243c
Source of Spectrum HAC-1-247-4d
Wiley ID 1799386