| SpectraBase Spectrum ID |
LhxJPsJFi8U |
| Name |
2-Butanone-3,3,4,4,4-D5, 1-(2,3,6-trimethylphenyl)- |
| CAS Registry Number |
54789-18-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13D5O |
| InChI |
InChI=1S/C13H18O/c1-9-5-6-10(2)13(12(9)4)8-7-11(3)14/h5-6H,7-8H2,1-4H3/i3D3,5D,6D |
| InChIKey |
YTAQPZUVJBPHEJ-NUBVBXQGSA-N |
| Molecular Weight |
195.317 g/mol |
| SMILES |
c1(c(c(C)c(c(c1C)[2D])[2D])C)CCC(=O)C([2D])([2D])[2D] |
| SPLASH |
splash10-001i-2900000000-c0d52579f3c502bea1e8 |
| Source of Spectrum |
O-2-2322-0 |
| Synonyms |
2,3,6-Trimethylphenylbutan-2-one-D5 |
| Wiley ID |
20791 |
