| SpectraBase Spectrum ID |
3rErDQXhntu |
| Name |
2-isocyanobenzoic acid ethyl ester |
| Alternate Name(s) |
Ethyl 2-Isocyanobenzoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H9NO2 |
| InChI |
InChI=1S/C10H9NO2/c1-3-13-10(12)8-6-4-5-7-9(8)11-2/h4-7H,3H2,1H3 |
| InChIKey |
HDYXYOBBXINYQO-UHFFFAOYSA-N |
| Molecular Weight |
175.187 g/mol |
| SMILES |
C(c1c(cccc1)[N+]#[C-])(=O)OCC |
| SPLASH |
splash10-001i-0900000000-2aaabb0b83ef975e0a68 |
| Source of Spectrum |
C4-2001-603-3 |
| Wiley ID |
1520082 |
