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2-(4-Chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidine-5,7(4H,6H)-dione
SpectraBase Compound ID Ccu1eUIGXF
InChI InChI=1S/C11H7ClN4O2/c12-7-3-1-6(2-4-7)10-14-11-13-8(17)5-9(18)16(11)15-10/h1-4H,5H2,(H,13,14,15,17)
InChIKey VKLFXPXRVSNJST-UHFFFAOYSA-N
Mol Weight 262.66 g/mol
Molecular Formula C11H7ClN4O2
Exact Mass 262.025753 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2a9NgM07Wvy
Name 2-(4-Chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidine-5,7(4H,6H)-dione
Appearance Brown powder
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Formula C11H7ClN4O2
InChI InChI=1S/C11H7ClN4O2/c12-7-3-1-6(2-4-7)10-14-11-13-8(17)5-9(18)16(11)15-10/h1-4H,5H2,(H,13,14,15,17)
InChIKey VKLFXPXRVSNJST-UHFFFAOYSA-N
Instrument Name Schimadzu GC/MS-QP5050A
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3184
Molecular Weight 262.656 g/mol
SMILES N1c2nc(n[n]2C(CC1=O)=O)-c1ccc(cc1)Cl
SPLASH splash10-0udi-9000000000-3ea0b09412e554d01330
Source of Spectrum Y-55-1464-10
Wiley ID 1879169