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3-(methylthio)-5-(quanidinocarbonyl)-6-chloro-1,2,4-triazine
SpectraBase Compound ID Gid9Xc3qn0M
InChI InChI=1S/C6H7ClN6OS/c1-15-6-10-2(3(7)12-13-6)4(14)11-5(8)9/h1H3,(H4,8,9,11,14)
InChIKey DZRWVECHPQIMFA-UHFFFAOYSA-N
Mol Weight 246.68 g/mol
Molecular Formula C6H7ClN6OS
Exact Mass 246.009058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EHW8k2xqLJ
Name 3-(methylthio)-5-(quanidinocarbonyl)-6-chloro-1,2,4-triazine
Alternate Name(s) N-{[6-chloro-3-(methylsulfanyl)-1,2,4-triazin-5-yl]carbonyl}guanidine
CAS Registry Number 96259-29-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7ClN6OS
InChI InChI=1S/C6H7ClN6OS/c1-15-6-10-2(3(7)12-13-6)4(14)11-5(8)9/h1H3,(H4,8,9,11,14)
InChIKey DZRWVECHPQIMFA-UHFFFAOYSA-N
Molecular Weight 246.676 g/mol
SMILES N(C(c1nc(SC)nnc1Cl)=O)C(=N)N
SPLASH splash10-004i-0920000000-0b285db6b12a6ecd8c02
Source of Spectrum J-50-2296-4
Wiley ID 1248296