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5-Chloro-3-(methylthio)-1,2,4-triazine-6-carboxylic acid ethyl ester
SpectraBase Compound ID tbnqb3hwTZ
InChI InChI=1S/C7H8ClN3O2S/c1-3-13-6(12)4-5(8)9-7(14-2)11-10-4/h3H2,1-2H3
InChIKey WXJHHRMJGBPYEG-UHFFFAOYSA-N
Mol Weight 233.67 g/mol
Molecular Formula C7H8ClN3O2S
Exact Mass 233.002575 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GrLokxQYch7
Name 5-Chloro-3-(methylthio)-1,2,4-triazine-6-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 5-chloranyl-3-methylsulfanyl-1,2,4-triazine-6-carboxylate Ethyl 5-chloro-3-(methylsulfanyl)-1,2,4-triazine-6-carboxylate
CAS Registry Number 75824-03-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8ClN3O2S
InChI InChI=1S/C7H8ClN3O2S/c1-3-13-6(12)4-5(8)9-7(14-2)11-10-4/h3H2,1-2H3
InChIKey WXJHHRMJGBPYEG-UHFFFAOYSA-N
Molecular Weight 233.673 g/mol
SMILES c1(nc(nnc1C(=O)OCC)SC)Cl
SPLASH splash10-000i-9400000000-6ab8bd2b3cf57e71cdcd
Source of Spectrum J-50-2297-9
Wiley ID 1234574