| SpectraBase Spectrum ID |
LmjRhKarlIZ |
| Name |
3-Penten-2-one-5,5,5-D3, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (E)- |
| CAS Registry Number |
93198-17-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H19D3O |
| InChI |
InChI=1S/C14H22O/c1-10-7-6-8-14(4,5)13(10)11(2)9-12(3)15/h9H,6-8H2,1-5H3/b11-9+/i2D3 |
| InChIKey |
XPPDQTDYEFKZHS-KTVWQEEUSA-N |
| Molecular Weight |
209.347 g/mol |
| SMILES |
C1(\C(=C\C(=O)C)C([2D])([2D])[2D])=C(CCCC1(C)C)C |
| SPLASH |
splash10-0006-2900000000-37c1fd4cccab14c124cf |
| Source of Spectrum |
H-67-1181-0 |
| Synonyms |
(E)-4-(2',6',6'-trimethyl-1'-cyclohexen-1'-yl)(5-12c,5,5,5-2H3)-3-penten-2-one |
| Wiley ID |
1205022 |
