| SpectraBase Compound ID | K1qzp4het96 |
|---|---|
| InChI | InChI=1S/C11H14BrNO2/c1-7(13-2)3-8-4-10-11(5-9(8)12)15-6-14-10/h4-5,7,13H,3,6H2,1-2H3 |
| InChIKey | ZIBHSZQEEWBQLW-UHFFFAOYSA-N |
| Mol Weight | 272.14 g/mol |
| Molecular Formula | C11H14BrNO2 |
| Exact Mass | 271.020792 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4L8LMOCrhFZ |
|---|---|
| Name | 2-bromo-4,5-MDMA |
| Catalog Number | 9001943 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H14BrNO2 |
| InChI | InChI=1S/C11H14BrNO2/c1-7(13-2)3-8-4-10-11(5-9(8)12)15-6-14-10/h4-5,7,13H,3,6H2,1-2H3 |
| InChIKey | ZIBHSZQEEWBQLW-UHFFFAOYSA-N |
| Molecular Weight | 272.142 g/mol |
| SMILES | N(C(Cc1c(cc2c(c1)OCO2)Br)C)C |
| SPLASH | splash10-0a4i-9100000000-003c99ff0c4b22805177 |
| Source of Spectrum | CAY-2023-1341-0 |
| Wiley ID | 1889278 |