SpectraBase Spectrum ID |
JHnKuRV0gW8 |
Name |
Acranil |
CAS Registry Number |
522-20-3 |
Classification |
Pharmaceutical drug, chemotherapeutic |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
387.171354787 u |
Formula |
C21H26ClN3O2 |
InChI |
InChI=1S/C21H26ClN3O2/c1-4-25(5-2)13-15(26)12-23-21-17-8-6-14(22)10-20(17)24-19-9-7-16(27-3)11-18(19)21/h6-11,15,26H,4-5,12-13H2,1-3H3,(H,23,24) |
InChIKey |
UDDPPYHULIXFDV-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
387.911 g/mol |
Nominal Mass |
387 u |
Quality |
987 |
Retention Index |
3067 |
SMILES |
OC(CNC1=C2C(=NC=3C1=CC=C(C3)Cl)C=CC(=C2)OC)CN(CC)CC |
SPLASH |
splash10-000i-9110000000-9c0e1bc9e36635c4a564 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-[(6-Chloro-2-methoxy-acridin-9-yl)amino]-3-diethylamino-propan-2-ol |
Technique |
GC/MS |
Wiley ID |
DD2024_000053 |