THJ2201 N-(5-hydroxypentyl) metabolite

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Systematic / IUPAC Name: [1-(5-Hydroxypentyl)indazol-3-yl]-naphthalen-1-ylmethanone

ID: Reference7489

Other Names: [1-(5-hydroxypentyl)-1H-indazol-3-yl]-1-naphthalenyl-methanone

Formula: C23H22N2O2

Class: Therapeutics/Prescription Drugs Drugs of Abuse/Illegal Drugs Sports Doping Drugs

Spectral Data

THJ2201 N-(5-hydroxypentyl) metabolite mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/8/2018 12:06:32 PM
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Identificators

InChI InChI=1S/C23H22N2O2/c26-16-7-1-6-15-25-21-14-5-4-12-20(21)22(24-25)23(27)19-13-8-10-17-9-2-3-11-18(17)19/h2-5,8-14,26H,1,6-7,15-16H2
InChI Key YBDCPWAZXZXQGE-UHFFFAOYSA-N
Canonical SMILES C1=CC=C2C(=C1)C=CC=C2C(=O)C3=NN(C4=CC=CC=C43)CCCCCO
CAS 1850409163
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Other Names [1-(5-hydroxypentyl)-1H-indazol-3-yl]-1-naphthalenyl-methanone

In Other Databases

PubChem 129597845