| SpectraBase Compound ID | GIgKyA57Bm4 |
|---|---|
| InChI | InChI=1S/C9H5BrN2S/c10-5-1-2-8-6(3-5)7-4-11-13-9(7)12-8/h1-4,12H |
| InChIKey | CAGIUGQMIOKICN-UHFFFAOYSA-N |
| Mol Weight | 253.12 g/mol |
| Molecular Formula | C9H5BrN2S |
| Exact Mass | 251.935682 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7YHXY1XhaFF |
|---|---|
| Name | 5-Bromobrassilexin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H5BrN2S |
| InChI | InChI=1S/C9H5BrN2S/c10-5-1-2-8-6(3-5)7-4-11-13-9(7)12-8/h1-4,12H |
| InChIKey | CAGIUGQMIOKICN-UHFFFAOYSA-N |
| Molecular Weight | 253.117 g/mol |
| SMILES | [nH]1c2c(c3c1snc3)cc(cc2)Br |
| SPLASH | splash10-0udi-0390000000-0a931a21fc49bc68e32e |
| Source of Spectrum | F-70-1834-24 |
| Wiley ID | 1596491 |