N-(1,3-Benzodioxol-5-ylmethyl)-4-propylbenzamide

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Systematic / IUPAC Name: N-(1,3-Benzodioxol-5-ylmethyl)-4-propylbenzamide

ID: Reference4074

Other Names: N-(2H-1,3-Benzodioxol-5-ylmethyl)-4-propylbenzamide;
Benzamide, N-(1,3-benzodioxol-5-ylmethyl)-4-propyl-

Formula: C18H19NO3

Spectral Data

N-(1,3-Benzodioxol-5-ylmethyl)-4-propylbenzamide 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 226
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/7/2016 8:12:12 AM
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Identificators

InChI InChI=1S/C18H19NO3/c1-2-3-13-4-7-15(8-5-13)18(20)19-11-14-6-9-16-17(10-14)22-12-21-16/h4-10H,2-3,11-12H2,1H3,(H,19,20)
InChI Key WMARTLDGKMGEIL-UHFFFAOYSA-N
Canonical SMILES CCCC1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3
CAS
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Other Names N-(2H-1,3-Benzodioxol-5-ylmethyl)-4-propylbenzamide;
Benzamide, N-(1,3-benzodioxol-5-ylmethyl)-4-propyl-

In Other Databases

PubChem 2811298
ChemSpider 2089710