| SpectraBase Spectrum ID |
23okb5pie5j |
| Name |
4-Fluoro EMB-BUTICA |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
31298 |
| Cell Type |
Capillary tube |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H27FN2O3 |
| IUPAC Name |
Ethyl (1-(4-fluorobutyl)-1H-indole-3-carbonyl)-L-valinate |
| InChI |
InChI=1S/C20H27FN2O3/c1-4-26-20(25)18(14(2)3)22-19(24)16-13-23(12-8-7-11-21)17-10-6-5-9-15(16)17/h5-6,9-10,13-14,18H,4,7-8,11-12H2,1-3H3,(H,22,24)/t18-/m0/s1 |
| InChIKey |
YRVNWHXSMRQPFR-SFHVURJKSA-N |
| Molecular Weight |
362.445 g/mol |
| Purity |
>=98% |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Source |
Nd:YAG |
| SMILES |
N(C(c1c[n](c2c1cccc2)CCCCF)=O)[C@@](C(C)C)(C(OCC)=O)[H] |
| Scans Performed |
1856 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
4-Fluoro EMB-BICA |
| Technique |
FT-Raman |
| UV - Neutral Conditions |
UVmax (nm): 218, 289 |
