| SpectraBase Compound ID | 7PCbkae4EEc |
|---|---|
| InChI | InChI=1S/C10H9NO2/c1-3-13-10(12)8-4-6-9(11-2)7-5-8/h4-7H,3H2,1H3 |
| InChIKey | AUCNDAZBLKMEEM-UHFFFAOYSA-N |
| Mol Weight | 175.19 g/mol |
| Molecular Formula | C10H9NO2 |
| Exact Mass | 175.063329 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9nbTbeOSTzI |
|---|---|
| Name | Ethyl 4-Isocyanobenzoate |
| Alternate Name(s) | 4-isocyanobenzoic acid ethyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H9NO2 |
| InChI | InChI=1S/C10H9NO2/c1-3-13-10(12)8-4-6-9(11-2)7-5-8/h4-7H,3H2,1H3 |
| InChIKey | AUCNDAZBLKMEEM-UHFFFAOYSA-N |
| Molecular Weight | 175.187 g/mol |
| SMILES | C(c1ccc(cc1)[N+]#[C-])(=O)OCC |
| SPLASH | splash10-0f89-1900000000-c0a90835b31e9c77a6a1 |
| Source of Spectrum | F-55-9637-4 |
| Wiley ID | 838837 |