| SpectraBase Compound ID | 7PqbPwj0nrt |
|---|---|
| InChI | InChI=1S/C19H25BrN4O2/c1-5-6-7-10-24-14-9-8-12(20)11-13(14)15(23-24)18(26)22-16(17(21)25)19(2,3)4/h5,8-9,11,16H,1,6-7,10H2,2-4H3,(H2,21,25)(H,22,26)/t16-/m1/s1 |
| InChIKey | SKMMFULKOGGVOT-MRXNPFEDSA-N |
| Mol Weight | 421.34 g/mol |
| Molecular Formula | C19H25BrN4O2 |
| Exact Mass | 420.116089 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 4HzDfeUvFRX |
|---|---|
| Name | ADB-5'Br-4en-PINACA |
| Source of Sample | Cayman Chemical Company |
| Catalog Number | 37741 |
| Lot Number | 0660814-3 |
| Cell Type | Neat on gold post |
| Copyright | Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H25BrN4O2 |
| InChI | InChI=1S/C19H25BrN4O2/c1-5-6-7-10-24-14-9-8-12(20)11-13(14)15(23-24)18(26)22-16(17(21)25)19(2,3)4/h5,8-9,11,16H,1,6-7,10H2,2-4H3,(H2,21,25)(H,22,26)/t16-/m1/s1 |
| InChIKey | SKMMFULKOGGVOT-MRXNPFEDSA-N |
| Raman Corrections | Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Source | Nd:YAG |
| SMILES | N(C(c1n[n](c2c1cc(cc2)Br)CCCC=C)=O)[C@](C(N)=O)(C(C)(C)C)[H] |
| Scans Performed | 3200 |
| Source of Spectrum | Forensic Spectral Research |
| Technique | FT-Raman |