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2-Ethyl-6-phenyl-5H-[1,3,4]thiadiazolo[3,2-a][1,3,5]triazine-5,7(6H)-dione
SpectraBase Compound ID 1udQA8TRUUH
InChI InChI=1S/C12H10N4O2S/c1-2-9-14-16-11(19-9)13-10(17)15(12(16)18)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKey FNXBDVFZMSNFIE-UHFFFAOYSA-N
Mol Weight 274.3 g/mol
Molecular Formula C12H10N4O2S
Exact Mass 274.052447 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JrGia7ZGQ19
Name 2-Ethyl-6-phenyl-5H-[1,3,4]thiadiazolo[3,2-a][1,3,5]triazine-5,7(6H)-dione
Alternate Name(s) 2-Ethyl-6-phenyl-[1,3,4]thiadiazolo[3,2-a][1,3,5]triazine-5,7-quinone
CAS Registry Number 69378-04-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N4O2S
InChI InChI=1S/C12H10N4O2S/c1-2-9-14-16-11(19-9)13-10(17)15(12(16)18)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKey FNXBDVFZMSNFIE-UHFFFAOYSA-N
Molecular Weight 274.298 g/mol
SMILES C1=2N(C(N(C(N2)=O)c2ccccc2)=O)N=C(S1)CC
SPLASH splash10-014i-1900000000-4b05b082028671c35d87
Source of Spectrum O-24-381-2
Wiley ID 1277731