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5-Hydroxy-1-[D3]methyl-3-pyrazole carboxylic acid-methylester
SpectraBase Compound ID 6RdrKzspxlz
InChI InChI=1S/C6H8N2O3/c1-8-5(9)3-4(7-8)6(10)11-2/h3,9H,1-2H3/i1D3
InChIKey IWOKRTHKTAEDLP-FIBGUPNXSA-N
Mol Weight 159.16 g/mol
Molecular Formula C6H52D3N2O3
Exact Mass 159.072322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2luBGBleXUb
Name 5-Hydroxy-1-[D3]methyl-3-pyrazole carboxylic acid-methylester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5D3N2O3
InChI InChI=1S/C6H8N2O3/c1-8-5(9)3-4(7-8)6(10)11-2/h3,9H,1-2H3/i1D3
InChIKey IWOKRTHKTAEDLP-FIBGUPNXSA-N
Literature Reference DOI 10.1002/cber.19791120521
Molecular Weight 159.159 g/mol
SMILES Oc1cc(n[n]1C([2D])([2D])[2D])C(=O)OC
SPLASH splash10-06vl-1900000000-e1f1e8d97d635ac1c654
Source of Spectrum K-112-1717-[D3]_3
Synonyms Methyl 5-hydroxy-1-(methyl-d3)-1H-pyrazole-3-carboxylate
Wiley ID 1794331