N-(3,4-Dimethoxyphenethyl)-1-benzothiophene-2-carboxamide

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Systematic / IUPAC Name: N-[2-(3,4-Dimethoxyphenyl)ethyl]-1-benzothiophene-2-carboxamide

ID: Reference6694

Other Names: Benzo[b]thiophene-2-carboxamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-

Formula: C19H19NO3S

Spectral Data

N-(3,4-Dimethoxyphenethyl)-1-benzothiophene-2-carboxamide 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 8/9/2017 8:17:26 AM
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Identificators

InChI InChI=1S/C19H19NO3S/c1-22-15-8-7-13(11-16(15)23-2)9-10-20-19(21)18-12-14-5-3-4-6-17(14)24-18/h3-8,11-12H,9-10H2,1-2H3,(H,20,21)
InChI Key XQLJHKLLLLQZDV-UHFFFAOYSA-N
Canonical SMILES COC1=C(C=C(C=C1)CCNC(=O)C2=CC3=CC=CC=C3S2)OC
CAS
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Other Names Benzo[b]thiophene-2-carboxamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-

In Other Databases

ChEMBL CHEMBL3753101
ChemSpider 2088964
PubChem 2810548