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N-[2-(1-n-Butyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-2-n-octylbenzamide
SpectraBase Compound ID BStlT0L6oN0
InChI InChI=1S/C24H38N4O/c1-5-7-9-10-11-12-15-20-16-13-14-17-21(20)23(29)25-24(3,4)22-19-28(27-26-22)18-8-6-2/h13-14,16-17,19H,5-12,15,18H2,1-4H3,(H,25,29)
InChIKey GJOJIWPRJMVJAP-UHFFFAOYSA-N
Mol Weight 398.6 g/mol
Molecular Formula C24H38N4O
Exact Mass 398.304562 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJrErBAs167
Name N-[2-(1-n-Butyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-2-n-octylbenzamide
Appearance Colorless solid
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Exact Mass 398.304561859 u
Formula C24H38N4O
InChI InChI=1S/C24H38N4O/c1-5-7-9-10-11-12-15-20-16-13-14-17-21(20)23(29)25-24(3,4)22-19-28(27-26-22)18-8-6-2/h13-14,16-17,19H,5-12,15,18H2,1-4H3,(H,25,29)
InChIKey GJOJIWPRJMVJAP-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201703191
Molecular Weight 398.595 g/mol
Quality 83
Reported Formula C24H38N4O
SMILES N(C(C1=CC=CC=C1CCCCCCCC)=O)C(C1=CN(N=N1)CCCC)(C)C
SPLASH splash10-0159-3916000000-88cbef02523bdcac8926
Source of Spectrum QE-23-SM28-3af (DOI: 10.1002/chem.201703191)
Wiley ID 1905723