| SpectraBase Compound ID | CFGr0ag4ML8 |
|---|---|
| InChI | InChI=1S/C9H9NO2S/c1-11-7-3-4-9(12-2)8(5-7)10-6-13/h3-5H,1-2H3 |
| InChIKey | RADQLZMDTYWZKA-UHFFFAOYSA-N |
| Mol Weight | 195.24 g/mol |
| Molecular Formula | C9H9NO2S |
| Exact Mass | 195.0354 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Cdshdnf1Kyp |
|---|---|
| Name | 2-Isothiocyanato-1,4-dimethoxybenzene |
| CAS Registry Number | 40532-06-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H9NO2S |
| InChI | InChI=1S/C9H9NO2S/c1-11-7-3-4-9(12-2)8(5-7)10-6-13/h3-5H,1-2H3 |
| InChIKey | RADQLZMDTYWZKA-UHFFFAOYSA-N |
| Molecular Weight | 195.236 g/mol |
| SMILES | c1(c(cc(cc1)OC)N=C=S)OC |
| SPLASH | splash10-000t-1900000000-3c5ee25aa40e52894c94 |
| Synonyms | 2,5-Dimethoxyphenyl isothiocyanate |
| Wiley ID | 1460493 |