Isoetharine

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Systematic / IUPAC Name: 4-[1-Hydroxy-2-(isopropylamino)butyl]-1,2-benzenediol

ID: Reference7303

Other Names: Bronkometer;
Bronkosol;
Dilabron;
Etyprenaline;
Isoetarin ; more

Formula: C13H21NO3

Class: Therapeutics/Prescription Drugs Sports Doping Drugs

Spectral Data

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

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 188
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/31/2018 1:07:22 PM
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Identificators

InChI InChI=1S/C13H21NO3/c1-4-10(14-8(2)3)13(17)9-5-6-11(15)12(16)7-9/h5-8,10,13-17H,4H2,1-3H3
InChI Key HUYWAWARQUIQLE-UHFFFAOYSA-N
Canonical SMILES CCC(C(C1=CC(=C(C=C1)O)O)O)NC(C)C
CAS
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Other Names Bronkometer;
Bronkosol;
Dilabron;
Etyprenaline;
Isoetarin;
Isoetarine;
Neoisuprel;
1,2-Benzenediol, 4-{1-hydroxy-2-[(1-methylethyl)amino]butyl}- ;
3,4-Dihydroxy-α-[1-(isopropylamino)propyl]benzyl alcohol;
4-[1-Hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;
4-{1-Hydroxy-2-[(propan-2-yl)amino]butyl}benzene-1,2-diol

In Other Databases

DrugBank DB00221
Wikipedia Isoetarine
PubChem 3762
ChEMBL CHEMBL1201213
KEGG C07053; D04625
ChemSpider 3630
ChEBI CHEBI:6005
ChemIDPlus 000530085; 007279756
HMDb HMDB14366