| SpectraBase Spectrum ID |
50BZIqgriWO |
| Name |
2-Hydroxy-4-methoxy-3,3-dimethyl-4-oxobutanoic acid (D3) |
| Comments |
Note: The molecular formula of the structure shown is C7H12O5 - which differs from the formula reported for the mass spectrum (C7H9D3O5) |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H9D3O5 |
| InChI |
InChI=1S/C7H12O5/c1-7(2,6(11)12-3)4(8)5(9)10/h4,8H,1-3H3,(H,9,10) |
| InChIKey |
MWNYKRXVDPDCRM-UHFFFAOYSA-N |
| Molecular Weight |
176.168 g/mol |
| SMILES |
OC(C(O)C(C(=O)OC)(C)C)=O |
| SPLASH |
splash10-0zna-9600000000-211778391b98c66aa8da |
| Synonyms |
2-Hydroxy-4-methoxy-3,3-dimethyl-4-oxo-butanoic acid (D3)
4-Methoxy-3,3-dimethyl-2-oxidanyl-4-oxidanylidene-butanoic acid (D3) |
| Wiley ID |
1489054 |
