| SpectraBase Spectrum ID |
LUCpPd0SnDr |
| Name |
ADB-5Br-INACA |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
36263 |
| Cell Type |
Neat on gold post |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H17BrN4O2 |
| IUPAC Name |
(S)-N-(1-Amino-3,3-dimethyl-1-oxobutan-2-yl)-5-bromo-1H-indazole-3-carboxamide |
| InChI |
InChI=1S/C14H17BrN4O2/c1-14(2,3)11(12(16)20)17-13(21)10-8-6-7(15)4-5-9(8)18-19-10/h4-6,11H,1-3H3,(H2,16,20)(H,17,21)(H,18,19)/t11-/m1/s1 |
| InChIKey |
AJGASUCDTSLMNP-LLVKDONJSA-N |
| Molecular Weight |
353.220 g/mol |
| Purity |
>=98% |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Source |
Nd:YAG |
| SMILES |
[nH]1c2c(c(C(N[C@](C(N)=O)(C(C)(C)C)[H])=O)n1)cc(cc2)Br |
| Scans Performed |
2432 |
| Source of Spectrum |
Forensic Spectral Research |
| Technique |
FT-Raman |
| UV - Neutral Conditions |
UVmax (nm): 214 |
