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HEXAZINONE PESTANAL
SpectraBase Compound ID C90qjjCrHFi
InChI InChI=1S/C12H20N4O2/c1-14(2)10-13-11(17)16(12(18)15(10)3)9-7-5-4-6-8-9/h9H,4-8H2,1-3H3
InChIKey CAWXEEYDBZRFPE-UHFFFAOYSA-N
Mol Weight 252.32 g/mol
Molecular Formula C12H20N4O2
Exact Mass 252.158626 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID g8vlVGZho2
Name HEXAZINONE
CAS Registry Number 51235-04-2
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 252.158625898 u
Formula C12H20N4O2
InChI InChI=1S/C12H20N4O2/c1-14(2)10-13-11(17)16(12(18)15(10)3)9-7-5-4-6-8-9/h9H,4-8H2,1-3H3
InChIKey CAWXEEYDBZRFPE-UHFFFAOYSA-N
Molecular Weight 252.318 g/mol
Nominal Mass 252 u
Number of Peaks 83
SMILES C1CCCC(C1)N1C(=O)N(C(=NC1=O)N(C)C)C
SPLASH splash10-00di-9700000000-1f7952398368c7ca64e4
Source of Spectrum Dr. Rolf Kuehnle
Synonyms 3-cyclohexyl-6-(dimethylamino)-1-methyl-1,3,5-triazine-2,4(1H,3H)-dione
Technique GC/MS
Wiley ID WID_MSPA_3876