| SpectraBase Compound ID | G1neO4jkDuk |
|---|---|
| InChI | InChI=1S/C12H16O/c1-5-11(13)12-9(3)6-8(2)7-10(12)4/h6-7H,5H2,1-4H3 |
| InChIKey | BMMJTVCPHGOCSW-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 | 9UcBxM1WAP4 |
|---|---|
| Name | 1-PROPANONE, 1-(2,4,6-TRIMETHYLPHENYL)- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H16O |
| InChI | InChI=1S/C12H16O/c1-5-11(13)12-9(3)6-8(2)7-10(12)4/h6-7H,5H2,1-4H3 |
| InChIKey | BMMJTVCPHGOCSW-UHFFFAOYSA-N |
| Molecular Weight | 176.1197 |
| SMILES | c1c(C)cc(C)c(C(CC)=O)c1C |
| SPLASH | splash10-0002-2900000000-42b18bd43070ad5447ba |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |