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1-Butyl-4-nitrobenzene
SpectraBase Compound ID 4HIm5DV0JmI
InChI InChI=1S/C10H13NO2/c1-2-3-4-9-5-7-10(8-6-9)11(12)13/h5-8H,2-4H2,1H3
InChIKey JZRBCNLSIDKBMG-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1h7YChHXSC
Name 1-Butyl-4-nitrobenzene
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-2-3-4-9-5-7-10(8-6-9)11(12)13/h5-8H,2-4H2,1H3
InChIKey JZRBCNLSIDKBMG-UHFFFAOYSA-N
Instrument Name HP 5995C
Ionization Type EI
Literature Reference DOI 10.1002/anie.202101571
Molecular Weight 179.219 g/mol
Reported Formula C10H13NO2
SMILES c1c(ccc(c1)CCCC)[N+]([O-])=O
SPLASH splash10-002u-5900000000-ee69d7c572d5d3ef8961
Source of Spectrum ACI-60-SM12-14
Wiley ID 1880323