1-(Benzylamino)-3-(3,4-dimethylphenoxy)propan-2-ol

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Systematic / IUPAC Name: 1-(Benzylamino)-3-(3,4-dimethylphenoxy)-2-propanol

ID: Reference3983

Other Names: Benzyl[3-(3,4-dimethylphenoxy)-2-hydroxypropyl]amine

Formula: C18H23NO2

Spectral Data

1-(Benzylamino)-3-(3,4-dimethylphenoxy)propan-2-ol 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 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/27/2016 8:36:13 AM
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Identificators

InChI InChI=1S/C18H23NO2/c1-14-8-9-18(10-15(14)2)21-13-17(20)12-19-11-16-6-4-3-5-7-16/h3-10,17,19-20H,11-13H2,1-2H3
InChI Key HEFPHRMJPGVGHY-UHFFFAOYSA-N
Canonical SMILES CC1=C(C=C(C=C1)OCC(CNCC2=CC=CC=C2)O)C
CAS
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Other Names Benzyl[3-(3,4-dimethylphenoxy)-2-hydroxypropyl]amine

In Other Databases

PubChem 2796006
ChEMBL CHEMBL1876645
ChemSpider 2074882