| SpectraBase Compound ID | 3kER4pXBZsX |
|---|---|
| InChI | InChI=1S/C20H27N3O3/c1-6-7-10-13-23-15-12-9-8-11-14(15)16(22-23)18(24)21-17(19(25)26-5)20(2,3)4/h6,8-9,11-12,17H,1,7,10,13H2,2-5H3,(H,21,24)/t17-/m1/s1 |
| InChIKey | LWOCBHBFWNGPGM-QGZVFWFLSA-N |
| Mol Weight | 357.45 g/mol |
| Molecular Formula | C20H27N3O3 |
| Exact Mass | 357.205242 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HbbMqkW8WkP |
|---|---|
| Name | MDMB-4en-PINACA |
| Catalog Number | 26097 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H27N3O3 |
| InChI | InChI=1S/C20H27N3O3/c1-6-7-10-13-23-15-12-9-8-11-14(15)16(22-23)18(24)21-17(19(25)26-5)20(2,3)4/h6,8-9,11-12,17H,1,7,10,13H2,2-5H3,(H,21,24)/t17-/m1/s1 |
| InChIKey | LWOCBHBFWNGPGM-QGZVFWFLSA-N |
| Molecular Weight | 357.454 g/mol |
| SMILES | N(C(=O)c1n[n](CCCC=C)c2c1cccc2)[C@@](C(C)(C)C)(C(OC)=O)[H] |
| SPLASH | splash10-03di-3792000000-2261c518b06e23344cfd |
| Source of Spectrum | CAY-2023-555-0 |
| Wiley ID | 1888515 |