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N-[(1-benzyltriazol-4-yl)methyl]-N,1-dipropyl-5-(trifluoromethyl)pyrrol-3-amine
SpectraBase Compound ID 9gUKjDtNIB3
InChI InChI=1S/C21H26F3N5/c1-3-10-27(19-12-20(21(22,23)24)28(16-19)11-4-2)14-18-15-29(26-25-18)13-17-8-6-5-7-9-17/h5-9,12,15-16H,3-4,10-11,13-14H2,1-2H3
InChIKey WARMAKICQGRCKT-UHFFFAOYSA-N
Mol Weight 405.47 g/mol
Molecular Formula C21H26F3N5
Exact Mass 405.21403 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6gCO5JKKAg9
Name N-[(1-benzyltriazol-4-yl)methyl]-N,1-dipropyl-5-(trifluoromethyl)pyrrol-3-amine
Appearance Brown oil
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Exact Mass 405.214030346 u
Formula C21H26F3N5
InChI InChI=1S/C21H26F3N5/c1-3-10-27(19-12-20(21(22,23)24)28(16-19)11-4-2)14-18-15-29(26-25-18)13-17-8-6-5-7-9-17/h5-9,12,15-16H,3-4,10-11,13-14H2,1-2H3
InChIKey WARMAKICQGRCKT-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4468
Molecular Weight 405.469 g/mol
Quality 90
Reported Formula C21H26F3N5
SMILES C(C1=CC=CC=C1)N1N=NC(=C1)CN(C1=CN(C(=C1)C(F)(F)F)CCC)CCC
SPLASH splash10-052f-9450600000-758be1184c9f65e9e280
Source of Spectrum Y-59-1317-6b (DOI: 10.1002/jhet.4468)
Wiley ID 1892494