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4-amino-6-tert-butyl-1-methyl-3-(methylthio)-6H-1,2,4-triazin-5-one
SpectraBase Compound ID 7Efy3UV3gnF
InChI InChI=1S/C9H18N4OS/c1-9(2,3)6-7(14)13(10)8(15-5)11-12(6)4/h6H,10H2,1-5H3
InChIKey OYSKDQUMRBQFAF-UHFFFAOYSA-N
Mol Weight 230.33 g/mol
Molecular Formula C9H18N4OS
Exact Mass 230.120132 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ixl62JPm9Vf
Name 4-amino-6-tert-butyl-1-methyl-3-(methylthio)-6H-1,2,4-triazin-5-one
Alternate Name(s) 4-amino-6-tert-butyl-1-methyl-3-methylsulfanyl-6H-1,2,4-triazin-5-one 4-azanyl-6-tert-butyl-1-methyl-3-methylsulfanyl-6H-1,2,4-triazin-5-one
CAS Registry Number 93678-89-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18N4OS
InChI InChI=1S/C9H18N4OS/c1-9(2,3)6-7(14)13(10)8(15-5)11-12(6)4/h6H,10H2,1-5H3
InChIKey OYSKDQUMRBQFAF-UHFFFAOYSA-N
Molecular Weight 230.330 g/mol
SMILES NN1C(C(C(C)(C)C)N(N=C1SC)C)=O
SPLASH splash10-00di-0900000000-e1dd78ba7e63f4b5d526
Source of Spectrum Y-22-15-7
Wiley ID 1231241