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1H-Dipyrazolo[3,4-b:4',3'-f]azepine, 4,5,8,9-tetrahydro-1,8,9-triphenyl-
SpectraBase Compound ID HcMxnBcuPnY
InChI InChI=1S/C26H21N5/c1-4-10-22(11-5-1)29-25-20(18-27-30(25)23-12-6-2-7-13-23)16-17-21-19-28-31(26(21)29)24-14-8-3-9-15-24/h1-15,18-19H,16-17H2
InChIKey FKXLELCOJKFQOI-UHFFFAOYSA-N
Mol Weight 403.49 g/mol
Molecular Formula C26H21N5
Exact Mass 403.179696 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HAubvbWJgS
Name 1H-Dipyrazolo[3,4-b:4',3'-f]azepine, 4,5,8,9-tetrahydro-1,8,9-triphenyl-
CAS Registry Number 126799-00-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H21N5
InChI InChI=1S/C26H21N5/c1-4-10-22(11-5-1)29-25-20(18-27-30(25)23-12-6-2-7-13-23)16-17-21-19-28-31(26(21)29)24-14-8-3-9-15-24/h1-15,18-19H,16-17H2
InChIKey FKXLELCOJKFQOI-UHFFFAOYSA-N
Molecular Weight 403.489 g/mol
SMILES c12N(c3c(CCc1cn[n]2-c1ccccc1)cn[n]3-c1ccccc1)c1ccccc1
SPLASH splash10-0udi-3000900000-543f8d60b01936326363
Source of Spectrum KC-1989-2097-7
Synonyms 1,8,9-Triphenyl-4,5,8,9-tetrahydro-1H-dipyrazolo[3,4-b:4',3'-f]azepine 1,8,9-triphenyl-4,5,8,9-tetrahydro-1H-dipyrazolo[3,4-b:4,3-f]azepine
Wiley ID 1370950