| SpectraBase Spectrum ID |
DkWMjlkDTYG |
| Name |
Crizotinib |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
12087 |
| Lot Number |
0449607-24 |
| CAS Registry Number |
877399-52-5 |
| Cell Type |
Capillary tube |
| Compound Type |
Pure |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22Cl2FN5O |
| IUPAC Name |
3-[(1R)-1-(2,6-Dichloro-3-fluorophenyl)ethoxy]-5-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-2-pyridinamine |
| InChI |
InChI=1S/C21H22Cl2FN5O/c1-12(19-16(22)2-3-17(24)20(19)23)30-18-8-13(9-27-21(18)25)14-10-28-29(11-14)15-4-6-26-7-5-15/h2-3,8-12,15,26H,4-7H2,1H3,(H2,25,27)/t12-/m1/s1 |
| InChIKey |
KTEIFNKAUNYNJU-GFCCVEGCSA-N |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Power |
903 mW |
| Raman Laser Source |
Nd:YAG |
| SMILES |
Nc1ncc(-c2c[n](C3CCNCC3)nc2)cc1O[C@@](c1c(c(ccc1Cl)F)Cl)(C)[H] |
| Scans Performed |
1920 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
PF 2341066; Xalfori |
| Technique |
FT-Raman |
