| SpectraBase Compound ID | JRcDO1xG8Ae |
|---|---|
| InChI | InChI=1S/C11H15NO2/c1-8(12-2)5-9-3-4-10-11(6-9)14-7-13-10/h3-4,6,8,12H,5,7H2,1-2H3/i2D3,5D,8D |
| InChIKey | SHXWCVYOXRDMCX-RMOCDOLISA-N |
| Mol Weight | 198.28 g/mol |
| Molecular Formula | C11H10D5NO2 |
| Exact Mass | 198.141662 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EEuMXYRWU5s |
|---|---|
| Name | 3,4-MDMA-d5 |
| Catalog Number | 18573 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H10D5NO2 |
| InChI | InChI=1S/C11H15NO2/c1-8(12-2)5-9-3-4-10-11(6-9)14-7-13-10/h3-4,6,8,12H,5,7H2,1-2H3/i2D3,5D,8D |
| InChIKey | SHXWCVYOXRDMCX-RMOCDOLISA-N |
| Molecular Weight | 198.277 g/mol |
| SMILES | N(C(C(c1ccc2c(c1)OCO2)[D])(C)[D])C([D])([D])[D] |
| SPLASH | splash10-03di-9100000000-8eb2196d257e71ff6f5b |
| Source of Spectrum | CAY-2023-981-0 |
| Wiley ID | 1888938 |