| SpectraBase Spectrum ID |
EWetJyi0oGL |
| Name |
2,6-Adamantanedione (D2) |
| Comments |
Note: The molecular formula of the structure shown is C10H12O2 - which differs from the formula reported for the mass spectrum (C10H10D2O2) |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H10D2O2 |
| InChI |
InChI=1S/C10H12O2/c11-9-5-1-6-3-8(9)4-7(2-5)10(6)12/h5-8H,1-4H2/t5-,6-,7+,8+ |
| InChIKey |
UBIAKEDDKXHXTB-UHFFFAOYSA-N |
| Molecular Weight |
164.204 g/mol |
| SMILES |
[C@]12(C[C@@]3(C([C@](C2)(C[C@](C1=O)(C3)[H])[H])=O)[H])[H] |
| SPLASH |
splash10-014i-9600000000-eda78d6f38c66feb8338 |
| Synonyms |
Adamantane-2,6-dione (D2)
adamantane-2,6-quinone (D2) |
| Wiley ID |
1481682 |
