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1-nitro-2-[3-(p-tolyl)prop-1-enyl]benzene
SpectraBase Compound ID 2mE9HXMVZ9a
InChI InChI=1S/C16H15NO2/c1-13-9-11-14(12-10-13)5-4-7-15-6-2-3-8-16(15)17(18)19/h2-4,6-12H,5H2,1H3
InChIKey OJLKUKZPRHNWEF-UHFFFAOYSA-N
Mol Weight 253.3 g/mol
Molecular Formula C16H15NO2
Exact Mass 253.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LUM6nddDjzy
Name 1-nitro-2-[3-(p-tolyl)prop-1-enyl]benzene
Appearance Yellow oil
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Formula C16H15NO2
InChI InChI=1S/C16H15NO2/c1-13-9-11-14(12-10-13)5-4-7-15-6-2-3-8-16(15)17(18)19/h2-4,6-12H,5H2,1H3
InChIKey OJLKUKZPRHNWEF-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201704260
Molecular Weight 253.301 g/mol
Quality 193
Reported Formula C16H15NO2
SMILES C1=CC=CC(=C1C=CCC1=CC=C(C=C1)C)[N+]([O-])=O
SPLASH splash10-0a4i-0920000000-a741a0c1256baafa90c2
Source of Spectrum ACI-56-SM20-s22 (DOI: 10.1002/anie.201704260)
Thin-Layer Chromatography 0.63 (petroleum ether/ethyl acetate, 5:1)
Wiley ID 1896319