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N-[2-(1-n-Butyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-2-n-pentylbenzamide
SpectraBase Compound ID GDZQAzmB5ve
InChI InChI=1S/C21H32N4O/c1-5-7-9-12-17-13-10-11-14-18(17)20(26)22-21(3,4)19-16-25(24-23-19)15-8-6-2/h10-11,13-14,16H,5-9,12,15H2,1-4H3,(H,22,26)
InChIKey OTRUIZKIBZRKNF-UHFFFAOYSA-N
Mol Weight 356.5 g/mol
Molecular Formula C21H32N4O
Exact Mass 356.257612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6w9DOgk9jGl
Name N-[2-(1-n-Butyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-2-n-pentylbenzamide
Appearance Colorless solid
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Exact Mass 356.257611665 u
Formula C21H32N4O
InChI InChI=1S/C21H32N4O/c1-5-7-9-12-17-13-10-11-14-18(17)20(26)22-21(3,4)19-16-25(24-23-19)15-8-6-2/h10-11,13-14,16H,5-9,12,15H2,1-4H3,(H,22,26)
InChIKey OTRUIZKIBZRKNF-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201703191
Molecular Weight 356.514 g/mol
Quality 93
Reported Formula C21H32N4O
SMILES N(C(C1=CC=CC=C1CCCCC)=O)C(C1=CN(N=N1)CCCC)(C)C
SPLASH splash10-02ai-2905000000-7abfbee4b86541c33bd6
Source of Spectrum QE-23-SM26-3ad (DOI: 10.1002/chem.201703191)
Wiley ID 1905721