| SpectraBase Compound ID | 3Xw4du3gydG |
|---|---|
| InChI | InChI=1S/C8H7NO2S2/c1-13-8(12)6-4-2-3-5-7(6)9(10)11/h2-5H,1H3 |
| InChIKey | CNESMTYVOIHURO-UHFFFAOYSA-N |
| Mol Weight | 213.27 g/mol |
| Molecular Formula | C8H7NO2S2 |
| Exact Mass | 212.991821 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B2maJ2r3ZmS |
|---|---|
| Name | 2-Nitrobenzenecarbodithioic acid methyl ester |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7NO2S2 |
| InChI | InChI=1S/C8H7NO2S2/c1-13-8(12)6-4-2-3-5-7(6)9(10)11/h2-5H,1H3 |
| InChIKey | CNESMTYVOIHURO-UHFFFAOYSA-N |
| Molecular Weight | 213.269 g/mol |
| SMILES | C(c1c(cccc1)N(=O)=O)(SC)=S |
| SPLASH | splash10-0udi-2900000000-b6c072abfc1baedb42a9 |
| Source of Spectrum | CV-2004-933-3 |
| Synonyms | Methyl 2-nitrobenzenecarbodithioate |
| Wiley ID | 1611234 |