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N-[2-(1-n-Butyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-4-(dimethylamino)benzamide
SpectraBase Compound ID IOdAIipm4Mj
InChI InChI=1S/C18H27N5O/c1-6-7-12-23-13-16(20-21-23)18(2,3)19-17(24)14-8-10-15(11-9-14)22(4)5/h8-11,13H,6-7,12H2,1-5H3,(H,19,24)
InChIKey YUXHMLMCXIRSDY-UHFFFAOYSA-N
Mol Weight 329.45 g/mol
Molecular Formula C18H27N5O
Exact Mass 329.221561 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdK627eZCG0
Name N-[2-(1-n-Butyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-4-(dimethylamino)benzamide
Appearance Yellow solid
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Exact Mass 329.221560508 u
Formula C18H27N5O
InChI InChI=1S/C18H27N5O/c1-6-7-12-23-13-16(20-21-23)18(2,3)19-17(24)14-8-10-15(11-9-14)22(4)5/h8-11,13H,6-7,12H2,1-5H3,(H,19,24)
InChIKey YUXHMLMCXIRSDY-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201703191
Molecular Weight 329.448 g/mol
Quality 118
Reported Formula C18H27N5O
SMILES N(C(C1=CC=C(C=C1)N(C)C)=O)C(C1=CN(N=N1)CCCC)(C)C
SPLASH splash10-0002-3922000000-bbf157aba9c0008768a6
Source of Spectrum QE-23-SM7-3l (DOI: 10.1002/chem.201703191)
Wiley ID 1905731