1-[(1,3-Benzodioxol-5-ylmethyl)amino]-3-(2-methoxyphenoxy)-2-propanol

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Systematic / IUPAC Name: 1-[(1,3-Benzodioxol-5-ylmethyl)amino]-3-(2-methoxyphenoxy)-2-propanol

ID: Reference4065

Other Names: (2H-1,3-Benzodioxol-5-ylmethyl)[2-hydroxy-3-(2-methoxyphenoxy)propyl]amine;
2-Propanol, 1-[(1,3-benzodioxol-5-ylmethyl)amino]-3-(2-methoxyphenoxy)-

Formula: C18H21NO5

Spectral Data

1-[(1,3-Benzodioxol-5-ylmethyl)amino]-3-(2-methoxyphenoxy)-2-propanol 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 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/4/2016 8:29:15 AM
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Identificators

InChI InChI=1S/C18H21NO5/c1-21-15-4-2-3-5-16(15)22-11-14(20)10-19-9-13-6-7-17-18(8-13)24-12-23-17/h2-8,14,19-20H,9-12H2,1H3
InChI Key ZHOKLZFHPAAPLQ-UHFFFAOYSA-N
Canonical SMILES COC1=CC=CC=C1OCC(CNCC2=CC3=C(C=C2)OCO3)O
CAS
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Other Names (2H-1,3-Benzodioxol-5-ylmethyl)[2-hydroxy-3-(2-methoxyphenoxy)propyl]amine;
2-Propanol, 1-[(1,3-benzodioxol-5-ylmethyl)amino]-3-(2-methoxyphenoxy)-

In Other Databases

PubChem 2810927
ChemSpider 2089342
ChEMBL CHEMBL1876654