Ractopamine

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Systematic / IUPAC Name: 4-(3-{[2-Hydroxy-2-(4-hydroxyphenyl)ethyl]amino}butyl)phenol

ID: Reference1682

Other Names: Benzenemethanol, 4-hydroxy-α-({[3-(4-hydroxyphenyl)-1-methylpropyl]amino}methyl)-;
4-{3-[2-Hydroxy-2-(4-hydroxyphenyl)-ethyl]aminobutyl}phenol;
4-(1-Hydroxy-2-{[4-(4-hydroxyphenyl)-2-butanyl]amino}ethyl)phenol;
4-(1-Hydroxy-2-{[4-(4-hydroxyphenyl)butan-2-yl]amino}ethyl)phenol

Formula: C18H23NO3

Class: Therapeutics/Prescription Drugs

Spectral Data

Ractopamine 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; Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 86
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 7/31/2015 8:32:39 AM
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Identificators

InChI InChI=1S/C18H23NO3/c1-13(2-3-14-4-8-16(20)9-5-14)19-12-18(22)15-6-10-17(21)11-7-15/h4-11,13,18-22H,2-3,12H2,1H3
InChI Key YJQZYXCXBBCEAQ-UHFFFAOYSA-N
Canonical SMILES CC(CCC1=CC=C(C=C1)O)NCC(C2=CC=C(C=C2)O)O
CAS 97825257
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Other Names Benzenemethanol, 4-hydroxy-α-({[3-(4-hydroxyphenyl)-1-methylpropyl]amino}methyl)-;
4-{3-[2-Hydroxy-2-(4-hydroxyphenyl)-ethyl]aminobutyl}phenol;
4-(1-Hydroxy-2-{[4-(4-hydroxyphenyl)-2-butanyl]amino}ethyl)phenol;
4-(1-Hydroxy-2-{[4-(4-hydroxyphenyl)butan-2-yl]amino}ethyl)phenol

In Other Databases

ChEMBL CHEMBL509336
ChemIDPlus 090274241; 097825257
PubChem 56052
Wikipedia Ractopamine
ChemSpider 50604