| SpectraBase Compound ID | LCHDLb5xADd |
|---|---|
| InChI | InChI=1S/C15H11NO2/c1-18-15(17)14-11-16-10-9-13(14)8-7-12-5-3-2-4-6-12/h2-6,9-11H,1H3 |
| InChIKey | WTDDPMSAAMXMJU-UHFFFAOYSA-N |
| Mol Weight | 237.26 g/mol |
| Molecular Formula | C15H11NO2 |
| Exact Mass | 237.078979 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8QKJo1l8zcT |
|---|---|
| Name | Methyl 4-(phenylethynyl)nicotinate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H11NO2 |
| InChI | InChI=1S/C15H11NO2/c1-18-15(17)14-11-16-10-9-13(14)8-7-12-5-3-2-4-6-12/h2-6,9-11H,1H3 |
| InChIKey | WTDDPMSAAMXMJU-UHFFFAOYSA-N |
| Molecular Weight | 237.258 g/mol |
| SMILES | C(#Cc1ccccc1)c1c(C(=O)OC)cncc1 |
| SPLASH | splash10-0ug0-1970000000-f6c16c1ce6b7e580545e |
| Source of Spectrum | F-65-2332-7a |
| Wiley ID | 1681365 |