SpectraBase Spectrum ID |
8G5jZMCXymu |
Name |
1-Propanone,1-(2,4-dimethylphenyl)-2-methyl |
CAS Registry Number |
23351-72-6 |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
176.120115134 u |
Formula |
C12H16O |
InChI |
InChI=1S/C12H16O/c1-8(2)12(13)11-6-5-9(3)7-10(11)4/h5-8H,1-4H3 |
InChIKey |
WXTUTRMIGPHKKK-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
176.259 g/mol |
Nominal Mass |
176 u |
Quality |
990 |
Retention Index |
1282 |
SMILES |
C=1(C(C(C)C)=O)C(=CC(=CC1)C)C |
SPLASH |
splash10-001i-5900000000-168350de6e408ab10847 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(2,4-Dimethylphenyl)-2-methylpropan-1-one |
Technique |
GC/MS |
Wiley ID |
DD2024_011579 |