| SpectraBase Spectrum ID |
2IdTcPeQsqy |
| Name |
AN2728 |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
21455 |
| Lot Number |
0499375-2 |
| Cell Type |
NMR tube |
| Compound Type |
Pure |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H10BNO3 |
| IUPAC Name |
4-[(1,3-Dihydro-1-hydroxy-2,1-benzoxaborol-5-yl)oxy]benzonitrile |
| InChI |
InChI=1S/C14H10BNO3/c16-8-10-1-3-12(4-2-10)19-13-5-6-14-11(7-13)9-18-15(14)17/h1-7,17H,9H2 |
| InChIKey |
USZAGAREISWJDP-UHFFFAOYSA-N |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Power |
502 mW |
| Raman Laser Source |
Nd:YAG |
| SMILES |
OB1c2ccc(cc2CO1)Oc1ccc(cc1)C#N |
| Scans Performed |
6848 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
Crisaborole |
| Technique |
FT-Raman |
