| SpectraBase Compound ID | CnmDjRFtNjr |
|---|---|
| InChI | InChI=1S/C12H16O4/c1-14-10-8-12(16-3)11(15-2)7-9(10)5-4-6-13/h6-8H,4-5H2,1-3H3 |
| InChIKey | XJLCKKVBWNWFDQ-UHFFFAOYSA-N |
| Mol Weight | 224.26 g/mol |
| Molecular Formula | C12H16O4 |
| Exact Mass | 224.104859 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DeXpBq0TVJ1 |
|---|---|
| Name | 3-(2,4,5-Trimethoxyphenyl)propanal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H16O4 |
| InChI | InChI=1S/C12H16O4/c1-14-10-8-12(16-3)11(15-2)7-9(10)5-4-6-13/h6-8H,4-5H2,1-3H3 |
| InChIKey | XJLCKKVBWNWFDQ-UHFFFAOYSA-N |
| Molecular Weight | 224.256 g/mol |
| SMILES | c1c(c(OC)cc(c1OC)CCC=O)OC |
| SPLASH | splash10-0089-1930000000-34cb49df4dce8dbacd40 |
| Source of Spectrum | MZ-34-2729-17 |
| Synonyms | 3-Asarylpropionaldehyde |
| Wiley ID | 1582533 |