| SpectraBase Spectrum ID |
GhyvwnMHtUQ |
| Name |
XL413 |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
24906 |
| Lot Number |
0526598-1 |
| CAS Registry Number |
2062200-97-7 |
| Cell Type |
Capillary tube |
| Compound Type |
Pure |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H13Cl2N3O2 |
| IUPAC Name |
8-Chloro-2-(2S)-2-pyrrolidinylbenzofuro[3,2-d]pyrimidin-4(3H)-one, monohydrochloride |
| InChI |
InChI=1S/C14H12ClN3O2.ClH/c15-7-3-4-10-8(6-7)11-12(20-10)14(19)18-13(17-11)9-2-1-5-16-9;/h3-4,6,9,16H,1-2,5H2,(H,17,18,19);1H/t9-;/m0./s1 |
| InChIKey |
UNDKJUKLBNARIZ-FVGYRXGTSA-N |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Power |
1200 mW |
| Raman Laser Source |
Nd:YAG |
| SMILES |
N1c2c(C(\N=C/1[C@]1(NCCC1)[H])=O)oc1c2cc(cc1)Cl.Cl |
| Scans Performed |
4096 |
| Source of Spectrum |
Forensic Spectral Research |
| Technique |
FT-Raman |
