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N-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-2,6-dimethylbenzamide
SpectraBase Compound ID AcYnwNdrnv5
InChI InChI=1S/C21H24N4O/c1-15-9-8-10-16(2)19(15)20(26)22-21(3,4)18-14-25(24-23-18)13-17-11-6-5-7-12-17/h5-12,14H,13H2,1-4H3,(H,22,26)
InChIKey HFHWZSZGSUMCCX-UHFFFAOYSA-N
Mol Weight 348.45 g/mol
Molecular Formula C21H24N4O
Exact Mass 348.195011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ig98tWd7uzv
Name N-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-2,6-dimethylbenzamide
Appearance Colorless solid
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Exact Mass 348.195011408 u
Formula C21H24N4O
InChI InChI=1S/C21H24N4O/c1-15-9-8-10-16(2)19(15)20(26)22-21(3,4)18-14-25(24-23-18)13-17-11-6-5-7-12-17/h5-12,14H,13H2,1-4H3,(H,22,26)
InChIKey HFHWZSZGSUMCCX-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201501134
Molecular Weight 348.450 g/mol
Quality 97
Reported Formula C21H24N4O
SMILES N(C(C=1C(=CC=CC1C)C)=O)C(C1=CN(N=N1)CC1=CC=CC=C1)(C)C
SPLASH splash10-000x-9616000000-aaa484d2b9e21a4590bd
Source of Spectrum QE-21-SM5-2a (DOI: 10.1002/chem.201501134)
Wiley ID 1906628