Ambroxol

enlarge

Systematic / IUPAC Name: 4-[(2-Amino-3,5-dibromophenyl)methylamino]cyclohexan-1-ol

ID: Reference2899

Other Names: Amboxol;
4-{[(2-Amino-3,5-dibromophenyl)methyl]amino}cyclohexanol ;
4-[(2-Amino-3,5-dibromobenzyl)amino]cyclohexan-1-ol ;
4-[(2-Amino-3,5-dibromobenzyl)amino]cyclohexanol;
Cyclohexanol, 4-{[(2-amino-3,5-dibromophenyl)methyl]amino}-

Formula: C13H18Br2N2O

Class: Endogenous Metabolites Therapeutics/Prescription Drugs

Spectral Data

Ambroxol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 165
Tandem Spectra MS1, MS2
Ionization Methods APCI
Analyzers FT
Last Modification 7/14/2015 6:20:21 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C13H18Br2N2O/c14-9-5-8(13(16)12(15)6-9)7-17-10-1-3-11(18)4-2-10/h5-6,10-11,17-18H,1-4,7,16H2
InChI Key JBDGDEWWOUBZPM-UHFFFAOYSA-N
Canonical SMILES C1CC(CCC1NCC2=CC(=CC(=C2N)Br)Br)O
CAS 18683915
Splash
Other Names Amboxol;
4-{[(2-Amino-3,5-dibromophenyl)methyl]amino}cyclohexanol ;
4-[(2-Amino-3,5-dibromobenzyl)amino]cyclohexan-1-ol ;
4-[(2-Amino-3,5-dibromobenzyl)amino]cyclohexanol;
Cyclohexanol, 4-{[(2-amino-3,5-dibromophenyl)methyl]amino}-

In Other Databases

ChemSpider 2047
PubChem 2132
Wikipedia Ambroxol
ChemIDPlus 018683915; 096989763
ChEMBL CHEMBL1477775