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1-Nitro-2-(nitrooxy)-1,4-diphenylbut-3-ene
SpectraBase Compound ID 8gogyPAU677
InChI InChI=1S/C16H14N2O5/c19-17(20)16(14-9-5-2-6-10-14)15(23-18(21)22)12-11-13-7-3-1-4-8-13/h1-12,15-16H/b12-11+
InChIKey TXTFXHWFUKZRFX-VAWYXSNFSA-N
Mol Weight 314.3 g/mol
Molecular Formula C16H14N2O5
Exact Mass 314.090272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KmPOyIxgzhp
Name 1-Nitro-2-(nitrooxy)-1,4-diphenylbut-3-ene
Alternate Name(s) (2E)-1-[nitro(phenyl)methyl]-3-phenyl-2-propenyl nitrate 1-Nitro-2-(nitrooxy)-1,4-diphenylbut-2-ene Nitric acid[(E)-1-nitro-1,4-diphenylbut-3-en-2-yl]ester Nitric acid[(E)-1-[nitro(phenyl)methyl]-3-phenyl-allyl]ester [(E)-1-nitro-1,4-diphenyl-but-3-en-2-yl]nitrate [(E)-1-[nitro(phenyl)methyl]-3-phenyl-allyl]nitrate Nitric acid [(E)-1-nitro-1,4-diphenylbut-3-en-2-yl] ester [(E)-1-nitro-1,4-diphenylbut-3-en-2-yl] nitrate [(E)-1-[nitro(phenyl)methyl]-3-phenyl-allyl] nitrate [(E)-1-nitro-1,4-diphenyl-but-3-en-2-yl] nitrate
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Formula C16H14N2O5
InChI InChI=1S/C16H14N2O5/c19-17(20)16(14-9-5-2-6-10-14)15(23-18(21)22)12-11-13-7-3-1-4-8-13/h1-12,15-16H/b12-11+
InChIKey TXTFXHWFUKZRFX-VAWYXSNFSA-N
Molecular Weight 314.297 g/mol
SMILES C(N(=O)=O)(C(ON(=O)=O)\C=C\c1ccccc1)c1ccccc1
SPLASH splash10-0v0u-9700000000-1651a865b6908cdbd1d7
Source of Spectrum K1-2001-746-16
Wiley ID 846821