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2-(N-methylbenz[d,e]imidazo-2-yl)-6-(1-tert-butoxycarbonylpyrrol-2-yl)-pyridine
SpectraBase Compound ID 523TAtqoTDW
InChI InChI=1S/C22H22N4O2/c1-22(2,3)28-21(27)26-14-8-13-19(26)16-10-7-11-17(23-16)20-24-15-9-5-6-12-18(15)25(20)4/h5-14H,1-4H3
InChIKey JJBSQZZXAKFFLS-UHFFFAOYSA-N
Mol Weight 374.44 g/mol
Molecular Formula C22H22N4O2
Exact Mass 374.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZOr0rMQrph
Name 2-(N-methylbenz[d,e]imidazo-2-yl)-6-(1-tert-butoxycarbonylpyrrol-2-yl)-pyridine
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N4O2
InChI InChI=1S/C22H22N4O2/c1-22(2,3)28-21(27)26-14-8-13-19(26)16-10-7-11-17(23-16)20-24-15-9-5-6-12-18(15)25(20)4/h5-14H,1-4H3
InChIKey JJBSQZZXAKFFLS-UHFFFAOYSA-N
Instrument Name Thermofinnigan MAT95XL
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.116
Molecular Weight 374.444 g/mol
SMILES c1ccc(nc1-c1[n](ccc1)C(=O)OC(C)(C)C)-c1[n](c2c(n1)cccc2)C
SPLASH splash10-000i-0090000000-14f36183fd0fddfad1b8
Source of Spectrum BJO-8-1046-6
Thin-Layer Chromatography Rf = 0.55 (SiO2, diethyl ether)
Wiley ID 1864881