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9-Benzyl-3,5-diphenyl-3H-dipyrazolo[1,5-a:4',3'-c]pyridine
SpectraBase Compound ID G5A4zDKdlQE
InChI InChI=1S/C27H20N4/c1-4-10-20(11-5-1)16-22-18-28-31-25(21-12-6-2-7-13-21)17-26-24(27(22)31)19-29-30(26)23-14-8-3-9-15-23/h1-15,17-19H,16H2
InChIKey SJCMBXLOAMRRLH-UHFFFAOYSA-N
Mol Weight 400.49 g/mol
Molecular Formula C27H20N4
Exact Mass 400.168797 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bq2wxPVb3u
Name 9-Benzyl-3,5-diphenyl-3H-dipyrazolo[1,5-a:4',3'-c]pyridine
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H20N4
InChI InChI=1S/C27H20N4/c1-4-10-20(11-5-1)16-22-18-28-31-25(21-12-6-2-7-13-21)17-26-24(27(22)31)19-29-30(26)23-14-8-3-9-15-23/h1-15,17-19H,16H2
InChIKey SJCMBXLOAMRRLH-UHFFFAOYSA-N
Instrument Name Shimadzu QP 1000
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.251
Molecular Weight 400.485 g/mol
SMILES c1n[n](-c2ccccc2)c2c1-c1[n](C(=C2)c2ccccc2)ncc1Cc1ccccc1
SPLASH splash10-0006-9000000000-2f600b3265ef079ee584
Source of Spectrum BJO-8-SM8-5i
Wiley ID 1867341