| SpectraBase Spectrum ID |
KsS1KgUNdcF |
| Name |
4-Chloro MDMB-BUTICA |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
31805 |
| Cell Type |
Capillary tube |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H27ClN2O3 |
| IUPAC Name |
Methyl (S)-2-(1-(4-chlorobutyl)-1H-indole-3-carboxamido)-3,3-dimethylbutanoate |
| InChI |
InChI=1S/C20H27ClN2O3/c1-20(2,3)17(19(25)26-4)22-18(24)15-13-23(12-8-7-11-21)16-10-6-5-9-14(15)16/h5-6,9-10,13,17H,7-8,11-12H2,1-4H3,(H,22,24)/t17-/m1/s1 |
| InChIKey |
AVOZNDFOMNISOO-QGZVFWFLSA-N |
| Molecular Weight |
378.900 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)CCCCCl)=O)[C@@](C(C)(C)C)(C(OC)=O)[H] |
| Scans Performed |
2496 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
4-Chloro MDMB-BICA |
| Technique |
FT-Raman |
| UV - Neutral Conditions |
UVmax (nm): 218, 290 |
