| SpectraBase Compound ID | D2ZxXUY4vas |
|---|---|
| InChI | InChI=1S/C11H12O/c1-3-4-11(12)10-7-5-9(2)6-8-10/h3,5-8H,1,4H2,2H3 |
| InChIKey | RGYFXKDNIKSMOA-UHFFFAOYSA-N |
| Mol Weight | 160.22 g/mol |
| Molecular Formula | C11H12O |
| Exact Mass | 160.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6gBJpTBI9GU |
|---|---|
| Name | 3-BUTEN-1-ONE, 1-(4-METHYLPHENYL)- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H12O |
| InChI | InChI=1S/C11H12O/c1-3-4-11(12)10-7-5-9(2)6-8-10/h3,5-8H,1,4H2,2H3 |
| InChIKey | RGYFXKDNIKSMOA-UHFFFAOYSA-N |
| Molecular Weight | 160.0885 |
| SMILES | c1c(C(CC=C)=O)ccc(C)c1 |
| SPLASH | splash10-014i-5900000000-6438bb0b3e29e1eba210 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |