| SpectraBase Compound ID | 1ix6nBDjAan |
|---|---|
| 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 |
| Mol Weight | 176.26 g/mol |
| Molecular Formula | C12H16O |
| Exact Mass | 176.120115 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8MR6AdWTU67 |
|---|---|
| Name | 1-PROPANONE, 1-(2,4-DIMETHYLPHENYL)-2-METHYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| 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 |
| Molecular Weight | 176.1197 |
| SMILES | c1c(C)cc(C)c(C(C(C)C)=O)c1 |
| SPLASH | splash10-001i-5900000000-4ccc30e721fb46b5b510 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |