| SpectraBase Spectrum ID |
EmJ1pygCRM5 |
| Name |
2,5-Bornanedione (D4) |
| Alternate Name(s) |
1,7,7-Trimethylbicyclo[2.2.1]heptane-2,5-dione (D4)
1,7,7-Trimethylnorbornane-2,5-dione (D4)
Bicyclo[2.2.1]heptane-2,5-dione, 1,7,7-trimethyl- (D4)
1,7,7-Trimethylnorbornane-2,5-quinone (D4)
4,7,7-Trimethylbicyclo[2.2.1]heptane-2,5-dione (D4) |
| CAS Registry Number |
1200-89-1 |
| Comments |
Note: The molecular formula of the structure shown is C10H14O2 - which differs from the formula reported for the mass spectrum (C10H10D4O2) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H10D4O2 |
| InChI |
InChI=1S/C10H14O2/c1-9(2)6-4-8(12)10(9,3)5-7(6)11/h6H,4-5H2,1-3H3/t6-,10-/m0/s1 |
| InChIKey |
UDIUFGIXIGLRSM-WKEGUHRASA-N |
| Molecular Weight |
166.220 g/mol |
| SMILES |
C1(C[C@]2(C(C[C@@]1(C2(C)C)C)=O)[H])=O |
| SPLASH |
splash10-00dl-9400000000-bf85ce1525b2f29a4e9b |
| Wiley ID |
1487769 |
