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Ethyl 3-(methylsulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazine-6-carboxylate
SpectraBase Compound ID 76EnaJOl6KM
InChI InChI=1S/C7H9N3O3S/c1-3-13-6(12)4-5(11)8-7(14-2)10-9-4/h3H2,1-2H3,(H,8,10,11)
InChIKey LVODHNQSZJASHM-UHFFFAOYSA-N
Mol Weight 215.23 g/mol
Molecular Formula C7H9N3O3S
Exact Mass 215.036462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Sv2Nj0e36o
Name Ethyl 3-(methylsulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazine-6-carboxylate
Alternate Name(s) 1,2,4-Triazine-6-carboxylic acid, 4,5-dihydro-3-methylthio-5-oxo-, ethyl ester 3-(methylthio)-5-oxo-2H-1,2,4-triazine-6-carboxylic acid ethyl ester 5-keto-3-(methylthio)-2H-1,2,4-triazine-6-carboxylic acid ethyl ester Ethyl 3-methylsulfanyl-5-oxidanylidene-2H-1,2,4-triazine-6-carboxylate Ethyl 3-methylsulfanyl-5-oxo-2H-1,2,4-triazine-6-carboxylate
CAS Registry Number 31143-85-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9N3O3S
InChI InChI=1S/C7H9N3O3S/c1-3-13-6(12)4-5(11)8-7(14-2)10-9-4/h3H2,1-2H3,(H,8,10,11)
InChIKey LVODHNQSZJASHM-UHFFFAOYSA-N
Molecular Weight 215.227 g/mol
SMILES N1C(=NN=C(C1=O)C(=O)OCC)SC
SPLASH splash10-0avs-9620000000-7014ee5589a51a880342
Source of Spectrum AD-0-2532-0
Wiley ID 1426993