| SpectraBase Spectrum ID |
GHM4491PLLw |
| Name |
(E)-1,1,1-trideuterio-4-(2,6,6-trimethyl-1-cyclohexenyl)-3-buten-2-one |
| Alternate Name(s) |
(E)-1,1,1-trideuterio-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one |
| CAS Registry Number |
54815-26-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H17D3O |
| InChI |
InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3/b8-7+/i2D3 |
| InChIKey |
PSQYTAPXSHCGMF-APFIAUBDSA-N |
| Molecular Weight |
195.320 g/mol |
| SMILES |
C1(\C=C\C(=O)C([2D])([2D])[2D])=C(CCCC1(C)C)C |
| SPLASH |
splash10-001j-6900000000-877b8fd2cbecd9f14756 |
| Source of Spectrum |
O-2-2341-0 |
| Wiley ID |
21271 |
