| SpectraBase Compound ID | 1a6vwECjKbr |
|---|---|
| InChI | InChI=1S/C14H15NO3/c1-3-4-5-10-12(16)11-8-15-7-6-9(11)13(17)14(10)18-2/h6-8H,3-5H2,1-2H3 |
| InChIKey | LNDQCVNEYBSVST-UHFFFAOYSA-N |
| Mol Weight | 245.28 g/mol |
| Molecular Formula | C14H15NO3 |
| Exact Mass | 245.105193 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3sOC7SGXs8 |
|---|---|
| Name | 7-Butyl-6-methoxy-5,8-isoquinolinedione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H15NO3 |
| InChI | InChI=1S/C14H15NO3/c1-3-4-5-10-12(16)11-8-15-7-6-9(11)13(17)14(10)18-2/h6-8H,3-5H2,1-2H3 |
| InChIKey | LNDQCVNEYBSVST-UHFFFAOYSA-N |
| Molecular Weight | 245.278 g/mol |
| SMILES | c1nccc2C(C(=C(C(c12)=O)CCCC)OC)=O |
| SPLASH | splash10-0f6t-0190000000-b6b5b9ead497e1f3ce02 |
| Source of Spectrum | E1-39-2258-25 |
| Wiley ID | 1519010 |