| SpectraBase Compound ID | KMMvAL6TEqU |
|---|---|
| InChI | InChI=1S/C8H8O4/c1-11-6-3-5(9)4-7(12-2)8(6)10/h3-4H,1-2H3/i3D |
| InChIKey | OLBNOBQOQZRLMP-WFVSFCRTSA-N |
| Mol Weight | 169.15 g/mol |
| Molecular Formula | C8H7DO4 |
| Exact Mass | 169.048535 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JwN0cDmTn7b |
|---|---|
| Name | 3-Deuterio-2,6-dimethoxy-1,4-benzoquinone |
| CAS Registry Number | 112520-79-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7DO4 |
| InChI | InChI=1S/C8H8O4/c1-11-6-3-5(9)4-7(12-2)8(6)10/h3-4H,1-2H3/i3D |
| InChIKey | OLBNOBQOQZRLMP-WFVSFCRTSA-N |
| Molecular Weight | 169.154 g/mol |
| SMILES | C1(C(=C([D])C(C=C1OC)=O)OC)=O |
| SPLASH | splash10-00di-9600000000-297e7226eebb7bbb443a |
| Source of Spectrum | J-53-4271-19 |
| Wiley ID | 1164131 |