SpectraBase Spectrum ID |
JJ0gczpRZ0y |
Name |
Clonidine |
CAS Registry Number |
4205-90-7 |
Classification |
Pharmaceutical drug, antihypertonic |
Comments |
Spectrum verified by crosschecking against external libraries (three reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
229.017352702 u |
Formula |
C9H9Cl2N3 |
InChI |
InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14) |
InChIKey |
GJSURZIOUXUGAL-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
230.098 g/mol |
Nominal Mass |
229 u |
Quality |
895 |
Retention Index |
1874 |
SMILES |
C1(=NC=2C(=CC=CC2Cl)Cl)NCCN1 |
SPLASH |
splash10-00c0-1980000000-520586fa155b1e583578 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-(2,6-Dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine |
Technique |
GC/MS |
Wiley ID |
DD2024_000742 |