| SpectraBase Compound ID | BQxBRyirQH4 |
|---|---|
| InChI | InChI=1S/C8H7ClN2S/c1-5-7(12-4-10)3-2-6(11)8(5)9/h2-3H,11H2,1H3 |
| InChIKey | DXTOSLCJWVLUQR-UHFFFAOYSA-N |
| Mol Weight | 198.67 g/mol |
| Molecular Formula | C8H7ClN2S |
| Exact Mass | 198.001847 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3cvxE3XhKhA |
|---|---|
| Name | 2-Chloro-3-methyl-4-thiocyanatoaniline |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7ClN2S |
| InChI | InChI=1S/C8H7ClN2S/c1-5-7(12-4-10)3-2-6(11)8(5)9/h2-3H,11H2,1H3 |
| InChIKey | DXTOSLCJWVLUQR-UHFFFAOYSA-N |
| Molecular Weight | 198.671 g/mol |
| SMILES | Nc1c(c(c(cc1)SC#N)C)Cl |
| SPLASH | splash10-0f6t-1910000000-9b336054cb98d5e81f21 |
| Source of Spectrum | C5-2005-963-2 |
| Synonyms | 4-Amino-3-chloro-2-methylphenyl thiocyanate |
| Wiley ID | 1618289 |