| SpectraBase Compound ID | DueFPiymzlm |
|---|---|
| InChI | InChI=1S/C9H5ClN2S/c10-5-1-2-6-7-4-11-13-9(7)12-8(6)3-5/h1-4,12H |
| InChIKey | XYDOCTKJSINWDD-UHFFFAOYSA-N |
| Mol Weight | 208.67 g/mol |
| Molecular Formula | C9H5ClN2S |
| Exact Mass | 207.986197 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | D5HBqyXmVc7 |
|---|---|
| Name | 6-Chlorobrassilexin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H5ClN2S |
| InChI | InChI=1S/C9H5ClN2S/c10-5-1-2-6-7-4-11-13-9(7)12-8(6)3-5/h1-4,12H |
| InChIKey | XYDOCTKJSINWDD-UHFFFAOYSA-N |
| Molecular Weight | 208.666 g/mol |
| SMILES | [nH]1c2c(c3c1snc3)ccc(c2)Cl |
| SPLASH | splash10-0a6r-0590000000-1b0def732ffc9ba0102c |
| Source of Spectrum | F-70-1834-24 |
| Wiley ID | 1596488 |