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Quinoline, 2-(1-methylpropyl)-4-nitro-, 1-oxide
SpectraBase Compound ID uZfzFVgBqH
InChI InChI=1S/C13H14N2O3/c1-3-9(2)12-8-13(15(17)18)10-6-4-5-7-11(10)14(12)16/h4-9H,3H2,1-2H3
InChIKey HDIYFNVZBKLFBM-UHFFFAOYSA-N
Mol Weight 246.27 g/mol
Molecular Formula C13H14N2O3
Exact Mass 246.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdMDiglyfLT
Name Quinoline, 2-(1-methylpropyl)-4-nitro-, 1-oxide
Alternate Name(s) 2-(1-Methylpropyl)-4-nitroquinoline N-oxide 2-sec-butyl-4-nitroquinoline 1-oxide
CAS Registry Number 120801-68-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O3
InChI InChI=1S/C13H14N2O3/c1-3-9(2)12-8-13(15(17)18)10-6-4-5-7-11(10)14(12)16/h4-9H,3H2,1-2H3
InChIKey HDIYFNVZBKLFBM-UHFFFAOYSA-N
Molecular Weight 246.266 g/mol
SMILES c1([n+](c2c(c(c1)N(=O)=O)cccc2)[O-])C(CC)C
SPLASH splash10-0pi0-0960000000-735b2a8f5f21d34c4dc5
Source of Spectrum KC-1989-253-0
Wiley ID 1248828