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2-[1-(1,6-heptadienyl)]-N-methyl-5-nitroaniline
SpectraBase Compound ID JmzpWy4L0TC
InChI InChI=1S/C14H18N2O2/c1-3-4-5-6-7-8-12-9-10-13(16(17)18)11-14(12)15-2/h3,7-11,15H,1,4-6H2,2H3/b8-7+
InChIKey TXBPCHMQFQNHKT-BQYQJAHWSA-N
Mol Weight 246.31 g/mol
Molecular Formula C14H18N2O2
Exact Mass 246.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7I9jeqwHnfe
Name 2-[1-(1,6-heptadienyl)]-N-methyl-5-nitroaniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18N2O2
InChI InChI=1S/C14H18N2O2/c1-3-4-5-6-7-8-12-9-10-13(16(17)18)11-14(12)15-2/h3,7-11,15H,1,4-6H2,2H3/b8-7+
InChIKey TXBPCHMQFQNHKT-BQYQJAHWSA-N
Molecular Weight 246.310 g/mol
SMILES N(c1cc(N(=O)=O)ccc1\C=C\CCCC=C)C
SPLASH splash10-0fwj-0930000000-8527ca9f6878c2d0d0b5
Source of Spectrum F-49-10023-6
Synonyms 2-[(1E)-1,6-heptadienyl]-N-methyl-5-nitroaniline N-{2-[(1E)-1,6-heptadienyl]-5-nitrophenyl}-N-methylamine
Wiley ID 788586