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(E)-1-methyl-3-(1-nitrohexa-3,5-dien-2-yl)benzene

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(E)-1-methyl-3-(1-nitrohexa-3,5-dien-2-yl)benzene
SpectraBase Compound ID 1pm62iEXrBk
InChI InChI=1S/C13H15NO2/c1-3-4-7-13(10-14(15)16)12-8-5-6-11(2)9-12/h3-9,13H,1,10H2,2H3/b7-4+
InChIKey AYCVJXHLEDCAPR-QPJJXVBHSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 23qagbIPXU
Name (E)-1-methyl-3-(1-nitrohexa-3,5-dien-2-yl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-3-4-7-13(10-14(15)16)12-8-5-6-11(2)9-12/h3-9,13H,1,10H2,2H3/b7-4+
InChIKey AYCVJXHLEDCAPR-QPJJXVBHSA-N
Literature Reference DOI 10.1039/c3cc46574h
Molecular Weight 217.268 g/mol
SMILES c1cc(cc(c1)C)C(\C=C\C=C)C[N+](=O)[O-]
SPLASH splash10-0a4i-1900000000-872d9dcf8490d96888fc
Source of Spectrum KD-50-484/SMS5-4f
Wiley ID 1754185