THJ

Systematic / IUPAC Name: 1-Pentyl-N-(8-quinolinyl)-1H-indazole-3-carboxamide

ID: Reference5441

Other Names: 1H-Indazole-3-carboxamide, 1-pentyl-N-8-quinolinyl-;
1-Pentyl-N-(quinolin-8-yl)-1H-indazole-3-carboxamide

Formula: C22H22N4O

Class: Drugs of Abuse/Illegal Drugs

Spectral Data

THJ 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 Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 8/5/2016 8:43:37 AM
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Identificators

InChI InChI=1S/C22H22N4O/c1-2-3-6-15-26-19-13-5-4-11-17(19)21(25-26)22(27)24-18-12-7-9-16-10-8-14-23-20(16)18/h4-5,7-14H,2-3,6,15H2,1H3,(H,24,27)
InChI Key YAYIQXMTUCPLHG-UHFFFAOYSA-N
Canonical SMILES O=C(NC1=C(N=CC=C2)C2=CC=C1)C3=NN(CCCCC)C4=C3C=CC=C4
CAS
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Other Names 1H-Indazole-3-carboxamide, 1-pentyl-N-8-quinolinyl-;
1-Pentyl-N-(quinolin-8-yl)-1H-indazole-3-carboxamide

In Other Databases

ChemSpider 29763731