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Quinoxaline, 2-methyl-3-(2-methylpropyl)-, 1,4-dioxide
SpectraBase Compound ID 3ZfNoMX6FjC
InChI InChI=1S/C13H16N2O2/c1-9(2)8-13-10(3)14(16)11-6-4-5-7-12(11)15(13)17/h4-7,9H,8H2,1-3H3
InChIKey HMLBWJFAPRTISX-UHFFFAOYSA-N
Mol Weight 232.28 g/mol
Molecular Formula C13H16N2O2
Exact Mass 232.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5o6Ux2QFz6L
Name Quinoxaline, 2-methyl-3-(2-methylpropyl)-, 1,4-dioxide
Alternate Name(s) 2-isobutyl-3-methylquinoxaline 1,4-dioxide
CAS Registry Number 77236-80-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O2
InChI InChI=1S/C13H16N2O2/c1-9(2)8-13-10(3)14(16)11-6-4-5-7-12(11)15(13)17/h4-7,9H,8H2,1-3H3
InChIKey HMLBWJFAPRTISX-UHFFFAOYSA-N
Molecular Weight 232.283 g/mol
SMILES c1([n+](c2c([n+](c1C)[O-])cccc2)[O-])CC(C)C
SPLASH splash10-001i-0090000000-33d586ae2dd470168a2b
Source of Spectrum K-114-243-0
Wiley ID 1233797