SpectraBase Spectrum ID |
5YJhrF5TljM |
Name |
Glafenin |
CAS Registry Number |
3820-67-5 |
Classification |
Pharmaceutical drug, analgesic |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
372.087684731 u |
Formula |
C19H17ClN2O4 |
InChI |
InChI=1S/C19H17ClN2O4/c20-12-5-6-14-17(7-8-21-18(14)9-12)22-16-4-2-1-3-15(16)19(25)26-11-13(24)10-23/h1-9,13,23-24H,10-11H2,(H,21,22) |
InChIKey |
GWOFUCIGLDBNKM-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
372.808 g/mol |
Nominal Mass |
372 u |
Quality |
951 |
Retention Index |
2892 |
SMILES |
OCC(COC(C=1C(NC=2C=3C(=CC(=CC3)Cl)N=CC2)=CC=CC1)=O)O |
SPLASH |
splash10-0f89-0191000000-f34b1b2da110ee2342b7 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2,3-Dihydroxypropyl-2-[(7-chloroquinolin-4-yl)amino]benzoate |
Technique |
GC/MS |
Wiley ID |
DD2024_001559 |