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S-(3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl) benzenecarbothioate
SpectraBase Compound ID 826HSfO1dnu
InChI InChI=1S/C10H7N3O3S/c14-7-8(12-13-10(16)11-7)17-9(15)6-4-2-1-3-5-6/h1-5H,(H2,11,13,14,16)
InChIKey NADNGNYULOPOGE-UHFFFAOYSA-N
Mol Weight 249.24 g/mol
Molecular Formula C10H7N3O3S
Exact Mass 249.020812 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4cVndMUZPM
Name S-(3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl) benzenecarbothioate
Alternate Name(s) 1,2,4-Triazine-3,5(2H,4H)-dione, 6-benzoylthio- benzenecarbothioic acid S-(3,5-dioxo-2H-1,2,4-triazin-6-yl) ester S-(3,5-dioxo-2H-1,2,4-triazin-6-yl) benzenecarbothioate thiobenzoic acid S-(3,5-diketo-2H-1,2,4-triazin-6-yl) ester
CAS Registry Number 24168-34-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7N3O3S
InChI InChI=1S/C10H7N3O3S/c14-7-8(12-13-10(16)11-7)17-9(15)6-4-2-1-3-5-6/h1-5H,(H2,11,13,14,16)
InChIKey NADNGNYULOPOGE-UHFFFAOYSA-N
Molecular Weight 249.244 g/mol
SMILES N1C(NN=C(C1=O)SC(=O)c1ccccc1)=O
SPLASH splash10-0pdi-9300000000-709af4e68fb89d08566c
Source of Spectrum AD-0-2532-0
Wiley ID 1420383