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3-phenyl-4-benzyl-5-benzyloxy-1-(2-pyridyl)pyrazole
SpectraBase Compound ID 2MlC7Tsm55C
InChI InChI=1S/C28H23N3O/c1-4-12-22(13-5-1)20-25-27(24-16-8-3-9-17-24)30-31(26-18-10-11-19-29-26)28(25)32-21-23-14-6-2-7-15-23/h1-19H,20-21H2
InChIKey LFAAZKWCCDUHGL-UHFFFAOYSA-N
Mol Weight 417.51 g/mol
Molecular Formula C28H23N3O
Exact Mass 417.184112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3DhKhDkcuk4
Name 3-phenyl-4-benzyl-5-benzyloxy-1-(2-pyridyl)pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H23N3O
InChI InChI=1S/C28H23N3O/c1-4-12-22(13-5-1)20-25-27(24-16-8-3-9-17-24)30-31(26-18-10-11-19-29-26)28(25)32-21-23-14-6-2-7-15-23/h1-19H,20-21H2
InChIKey LFAAZKWCCDUHGL-UHFFFAOYSA-N
Instrument Name MStation JMS 700
Ionization Type EI
Molecular Weight 417.512 g/mol
SMILES c1(ccccn1)-[n]1nc(c(c1OCc1ccccc1)Cc1ccccc1)-c1ccccc1
SPLASH splash10-0006-9959000000-aef6aeae8332d5f0bed3
Source of Spectrum CN104755077A
Wiley ID 1850401