| SpectraBase Spectrum ID |
2pABvt9ZB2 |
| Name |
3-Buten-2-one, 4-[2-methyl-6,6-di(methyl-D3)-1-cyclohexen-1-yl]- |
| CAS Registry Number |
55570-98-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14D6O |
| 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+/i3D3,4D3 |
| InChIKey |
PSQYTAPXSHCGMF-CAHHJABKSA-N |
| Molecular Weight |
198.339 g/mol |
| SMILES |
C1(\C=C\C(=O)C)=C(CCCC1(C([2D])([2D])[2D])C([2D])([2D])[2D])C |
| SPLASH |
splash10-001l-6900000000-da1798cdb50f217dd5e3 |
| Source of Spectrum |
O-2-2342-0 |
| Synonyms |
.beta.-ionone-D6 |
| Wiley ID |
21272 |
![3-Buten-2-one, 4-[2-methyl-6,6-di(methyl-D3)-1-cyclohexen-1-yl]-](/api/spectrum/2pABvt9ZB2/structure.png?h=300&w=458 "3-Buten-2-one, 4-[2-methyl-6,6-di(methyl-D3)-1-cyclohexen-1-yl]-")
