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(6-chloro-7-methyl-5-oxo-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetic acid
SpectraBase Compound ID 8BgSwBe5Oq7
InChI InChI=1S/C8H7ClN4O3/c1-3-6(9)7(16)11-8-10-4(2-5(14)15)12-13(3)8/h2H2,1H3,(H,14,15)(H,10,11,12,16)
InChIKey RQQNWVKNMVWQKH-UHFFFAOYSA-N
Mol Weight 242.62 g/mol
Molecular Formula C8H7ClN4O3
Exact Mass 242.020668 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5exKB0TJMeg
Name (6-chloro-7-methyl-5-oxo-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7ClN4O3
InChI InChI=1S/C8H7ClN4O3/c1-3-6(9)7(16)11-8-10-4(2-5(14)15)12-13(3)8/h2H2,1H3,(H,14,15)(H,10,11,12,16)
InChIKey RQQNWVKNMVWQKH-UHFFFAOYSA-N
Molecular Weight 242.622 g/mol
SMILES N1C(C(=C([n]2c1nc(CC(=O)O)n2)C)Cl)=O
SPLASH splash10-00ke-9700000000-2d13d8d831eebb82bc7b
Source of Spectrum IY-3-84-0
Wiley ID 1718032