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Hex-5-ynyl-(2-nitro-phenyl)-amine
SpectraBase Compound ID AE0cqadIzlP
InChI InChI=1S/C12H14N2O2/c1-2-3-4-7-10-13-11-8-5-6-9-12(11)14(15)16/h1,5-6,8-9,13H,3-4,7,10H2
InChIKey XILQKPCGEGNWDM-UHFFFAOYSA-N
Mol Weight 218.26 g/mol
Molecular Formula C12H14N2O2
Exact Mass 218.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9JpQlXpxYpO
Name Hex-5-ynyl-(2-nitro-phenyl)-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O2
InChI InChI=1S/C12H14N2O2/c1-2-3-4-7-10-13-11-8-5-6-9-12(11)14(15)16/h1,5-6,8-9,13H,3-4,7,10H2
InChIKey XILQKPCGEGNWDM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000211
Molecular Weight 218.256 g/mol
SMILES N(c1c(cccc1)[N+](=O)[O-])CCCCC#C
SPLASH splash10-002g-9800000000-a6355e848f760740f8ec
Source of Spectrum ASC-352-1870/SM7-20
Synonyms N-(hex-5-yn-1-yl)-2-nitroaniline
Wiley ID 1763890