SpectraBase Compound ID | AJyod3HlopB |
---|---|
InChI | InChI=1S/C8H8O4/c1-5-3-7(11-2)6(4-9)8(10)12-5/h3-4H,1-2H3/i2D3 |
InChIKey | PSTKEOZTVODBQB-BMSJAHLVSA-N |
Mol Weight | 171.17 g/mol |
Molecular Formula | C8H5D3O4 |
Exact Mass | 171.061089 g/mol |
SpectraBase Spectrum ID | J2TKe3ZHByj |
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Name | 3-Formyl-4-[D3]Methoxy-6-methyl-2H-pyran-2-one |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H5D3O4 |
InChI | InChI=1S/C8H8O4/c1-5-3-7(11-2)6(4-9)8(10)12-5/h3-4H,1-2H3/i2D3 |
InChIKey | PSTKEOZTVODBQB-BMSJAHLVSA-N |
Molecular Weight | 171.166 g/mol |
SMILES | C1(=C(C=C(C)OC1=O)OC([D])([D])[D])C=O |
SPLASH | splash10-0006-6900000000-f08eed3a1be881fef44b |
Source of Spectrum | KC-0-1230-16 |
Wiley ID | 827814 |