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1-(2-(Azidomethyl)phenyl)-3,5-diphenyl-1H-pyrazole
SpectraBase Compound ID B6gK2Mpd7zP
InChI InChI=1S/C22H17N5/c23-26-24-16-19-13-7-8-14-21(19)27-22(18-11-5-2-6-12-18)15-20(25-27)17-9-3-1-4-10-17/h1-15H,16H2
InChIKey OUAFGYOSHHOUOJ-UHFFFAOYSA-N
Mol Weight 351.41 g/mol
Molecular Formula C22H17N5
Exact Mass 351.148396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GXXEjQgUK
Name 1-(2-(Azidomethyl)phenyl)-3,5-diphenyl-1H-pyrazole
Appearance Yellowish-white solid
Carrier Gas Helium
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Exact Mass 351.148395567 u
Formula C22H17N5
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C22H17N5/c23-26-24-16-19-13-7-8-14-21(19)27-22(18-11-5-2-6-12-18)15-20(25-27)17-9-3-1-4-10-17/h1-15H,16H2
InChIKey OUAFGYOSHHOUOJ-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201502995
Molecular Weight 351.413 g/mol
Quality 198
Reported Formula C22H17N5
SMILES C(N=[N+]=[N-])C1=C(C=CC=C1)N1N=C(C=C1C1=CC=CC=C1)C1=CC=CC=C1
SPLASH splash10-00dj-2293000000-4009e6c5fcba6ac408c1
Source of Spectrum QE-21-SM58-3z (DOI: 10.1002/chem.201502995)
Thin-Layer Chromatography 0.29 (hexane/EtOAc, 10:1)
Wiley ID 1907322