| SpectraBase Spectrum ID |
4tKI7zl16nq |
| Name |
Benzoic acid, 4-isothiocyanato-, ethyl ester |
| CAS Registry Number |
1205-06-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H9NO2S |
| InChI |
InChI=1S/C10H9NO2S/c1-2-13-10(12)8-3-5-9(6-4-8)11-7-14/h3-6H,2H2,1H3 |
| InChIKey |
MLOJHUCMCKBDLV-UHFFFAOYSA-N |
| Molecular Weight |
207.247 g/mol |
| SMILES |
CCOC(=O)c1ccc(N=C=S)cc1 |
| SPLASH |
splash10-03di-5920000000-9a4acc686a8dfec03dea |
| Source of Spectrum |
JX-2015-5-868 |
| Synonyms |
Ethyl 4-isothiocyanatobenzoate
Phenylisothiocyanate, 4-ethoxycarbonyl |
| Wiley ID |
1727610 |
