| SpectraBase Compound ID | CeSQNLd4gWE |
|---|---|
| InChI | InChI=1S/C19H26BrFN4O2/c1-19(2,3)16(17(22)26)23-18(27)15-13-11-12(20)7-8-14(13)25(24-15)10-6-4-5-9-21/h7-8,11,16H,4-6,9-10H2,1-3H3,(H2,22,26)(H,23,27)/t16-/m1/s1 |
| InChIKey | NFPAJGRKUHSQLR-MRXNPFEDSA-N |
| Mol Weight | 441.35 g/mol |
| Molecular Formula | C19H26BrFN4O2 |
| Exact Mass | 440.122317 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | GPRzUMgGEhE |
|---|---|
| Name | 5-Fluoro ADB-5'Br-PINACA |
| Source of Sample | Cayman Chemical Company |
| Catalog Number | 37963 |
| Lot Number | 0665254-5 |
| Cell Type | Neat on gold post |
| Copyright | Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H26BrFN4O2 |
| InChI | InChI=1S/C19H26BrFN4O2/c1-19(2,3)16(17(22)26)23-18(27)15-13-11-12(20)7-8-14(13)25(24-15)10-6-4-5-9-21/h7-8,11,16H,4-6,9-10H2,1-3H3,(H2,22,26)(H,23,27)/t16-/m1/s1 |
| InChIKey | NFPAJGRKUHSQLR-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)CCCCCF)=O)[C@](C(N)=O)(C(C)(C)C)[H] |
| Scans Performed | 1280 |
| Source of Spectrum | Forensic Spectral Research |
| Technique | FT-Raman |