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N,N-dimethyl-4-(2-nitro-1-phenylethyl)aniline
SpectraBase Compound ID 63mpq23YdfJ
InChI InChI=1S/C16H18N2O2/c1-17(2)15-10-8-14(9-11-15)16(12-18(19)20)13-6-4-3-5-7-13/h3-11,16H,12H2,1-2H3
InChIKey IBQDWSQSWKUZFI-UHFFFAOYSA-N
Mol Weight 270.33 g/mol
Molecular Formula C16H18N2O2
Exact Mass 270.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BB9mUwi5A5X
Name N,N-dimethyl-4-(2-nitro-1-phenylethyl)aniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2O2
InChI InChI=1S/C16H18N2O2/c1-17(2)15-10-8-14(9-11-15)16(12-18(19)20)13-6-4-3-5-7-13/h3-11,16H,12H2,1-2H3
InChIKey IBQDWSQSWKUZFI-UHFFFAOYSA-N
Instrument Name Agilent 7820 A-5890 B
Ionization Type EI
Literature Reference DOI 10.1002/aoc.5578
Molecular Weight 270.332 g/mol
SMILES c1(N(C)C)ccc(C(C[N+](=O)[O-])c2ccccc2)cc1
SPLASH splash10-01w0-1790000000-253476bce5e8637b73a2
Source of Spectrum AOC-34-SM18-Fig. S26
Wiley ID 1839574