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(E) 2-(2-Methylphenyl)-1-nitropent-3-ene
SpectraBase Compound ID HPPNnkk4DX3
InChI InChI=1S/C12H15NO2/c1-3-6-11(9-13(14)15)12-8-5-4-7-10(12)2/h3-8,11H,9H2,1-2H3/b6-3+
InChIKey ZLHMPHOSSWABSV-ZZXKWVIFSA-N
Mol Weight 205.26 g/mol
Molecular Formula C12H15NO2
Exact Mass 205.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jPQLhnDY8
Name (E) 2-(2-Methylphenyl)-1-nitropent-3-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO2
InChI InChI=1S/C12H15NO2/c1-3-6-11(9-13(14)15)12-8-5-4-7-10(12)2/h3-8,11H,9H2,1-2H3/b6-3+
InChIKey ZLHMPHOSSWABSV-ZZXKWVIFSA-N
Literature Reference DOI 10.1021/ol500114m
Molecular Weight 205.257 g/mol
SMILES C\C=C\C(C[N+]([O-])=O)c1ccccc1C
SPLASH splash10-05ox-2900000000-b953cb8f1a123bf948bd
Source of Spectrum A1-16-1362/SMS12-2j
Synonyms (E)-1-methyl-2-(1-nitropent-3-en-2-yl)benzene
Wiley ID 1749189