| SpectraBase Spectrum ID |
LOKQcQfDWrN |
| Name |
1,4-Diacetyl-4-methyl-3-formylmethylcyclohexane |
| Alternate Name(s) |
[(1S,2S,5R)-2,5-diacetyl-2-methylcyclohexyl]acetaldehyde |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20O3 |
| InChI |
InChI=1S/C13H20O3/c1-9(15)11-4-6-13(3,10(2)16)12(8-11)5-7-14/h7,11-12H,4-6,8H2,1-3H3/t11-,12-,13-/m1/s1 |
| InChIKey |
KCVWZIFKXCCNNP-JHJVBQTASA-N |
| Molecular Weight |
224.300 g/mol |
| SMILES |
[C@@]1([C@@](C[C@@](CC1)(C(=O)C)[H])(CC=O)[H])(C(=O)C)C |
| SPLASH |
splash10-0k9l-1900000000-47eadaeda63f8c80c0c3 |
| Source of Spectrum |
O1-54-771-5 |
| Wiley ID |
1591002 |
