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1-Trideuterioacetoxymethylthymine
SpectraBase Compound ID 7zjd7XiZCFz
InChI InChI=1S/C8H10N2O4/c1-5-3-10(4-14-6(2)11)8(13)9-7(5)12/h3H,4H2,1-2H3,(H,9,12,13)/i2D3
InChIKey LGVPGGJEEYFNCR-BMSJAHLVSA-N
Mol Weight 201.2 g/mol
Molecular Formula C8H7D3N2O4
Exact Mass 201.082887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5wXJ68yxRUQ
Name 1-Trideuterioacetoxymethylthymine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7D3N2O4
InChI InChI=1S/C8H10N2O4/c1-5-3-10(4-14-6(2)11)8(13)9-7(5)12/h3H,4H2,1-2H3,(H,9,12,13)/i2D3
InChIKey LGVPGGJEEYFNCR-BMSJAHLVSA-N
Molecular Weight 201.196 g/mol
SMILES N1C(C(=CN(C1=O)COC(=O)C([D])([D])[D])C)=O
SPLASH splash10-0fb9-0920000000-89595c7a32c322b60e97
Source of Spectrum F-53-2615-3
Wiley ID 800702