| SpectraBase Compound ID | KedkV8qb7mf |
|---|---|
| InChI | InChI=1S/C19H27N3O4/c1-19(2,3)16(18(25)26-4)20-17(24)15-13-9-5-6-10-14(13)22(21-15)11-7-8-12-23/h5-6,9-10,16,23H,7-8,11-12H2,1-4H3,(H,20,24)/t16-/m1/s1 |
| InChIKey | RYJWSRJLIKZYSA-MRXNPFEDSA-N |
| Mol Weight | 361.44 g/mol |
| Molecular Formula | C19H27N3O4 |
| Exact Mass | 361.200156 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 10ddRSTnFW8 |
|---|---|
| Name | 4-fluoro MDMB-BUTINACA N-(4-hydroxybutyl) metabolite |
| Catalog Number | 26857 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H27N3O4 |
| InChI | InChI=1S/C19H27N3O4/c1-19(2,3)16(18(25)26-4)20-17(24)15-13-9-5-6-10-14(13)22(21-15)11-7-8-12-23/h5-6,9-10,16,23H,7-8,11-12H2,1-4H3,(H,20,24)/t16-/m1/s1 |
| InChIKey | RYJWSRJLIKZYSA-MRXNPFEDSA-N |
| Molecular Weight | 361.442 g/mol |
| SMILES | OCCCC[n]1nc(C(=O)N[C@@](C(C)(C)C)(C(OC)=O)[H])c2c1cccc2 |
| SPLASH | splash10-014j-5982000000-988d968536eb360a68a9 |
| Source of Spectrum | CAY-2023-489-0 |
| Wiley ID | 1888452 |