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(E)-5-(But-1-enyl)-8-nitroquinoline
SpectraBase Compound ID 86DsLjiCtQl
InChI InChI=1S/C13H12N2O2/c1-2-3-5-10-7-8-12(15(16)17)13-11(10)6-4-9-14-13/h3-9H,2H2,1H3/b5-3+
InChIKey AEZCIAYSJKKAHN-HWKANZROSA-N
Mol Weight 228.25 g/mol
Molecular Formula C13H12N2O2
Exact Mass 228.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CzlqNMW3nz3
Name (E)-5-(But-1-enyl)-8-nitroquinoline
Appearance Pink crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 228.089877632 u
Formula C13H12N2O2
InChI InChI=1S/C13H12N2O2/c1-2-3-5-10-7-8-12(15(16)17)13-11(10)6-4-9-14-13/h3-9H,2H2,1H3/b5-3+
InChIKey AEZCIAYSJKKAHN-HWKANZROSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201801018
Molecular Weight 228.251 g/mol
Quality 376
Reported Formula C13H12N2O2
SMILES [N+]([O-])(=O)C1=C2N=CC=CC2=C(\C=C\CC)C=C1
SPLASH splash10-00fu-0910000000-c31ab7db007646bebdce
Source of Spectrum K1-2018-6655-7l (DOI: 10.1002/ejoc.201801018)
Wiley ID 1896975