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1-(4-Chlorobenzyl)-4-(4-phenylpiperazino)triazolo[4,5-b][1,5]benzoxazepine

View entire compound with spectra: 1 MS (GC)

1-(4-Chlorobenzyl)-4-(4-phenylpiperazino)triazolo[4,5-b][1,5]benzoxazepine
SpectraBase Compound ID LdXnWdwIKLq
InChI InChI=1S/C26H23ClN6O/c27-20-12-10-19(11-13-20)18-33-26-24(29-30-33)25(28-22-8-4-5-9-23(22)34-26)32-16-14-31(15-17-32)21-6-2-1-3-7-21/h1-13H,14-18H2
InChIKey LZZXTQXOGOYFDN-UHFFFAOYSA-N
Mol Weight 470.96 g/mol
Molecular Formula C26H23ClN6O
Exact Mass 470.162187 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JtUYL9kI7nl
Name 1-(4-Chlorobenzyl)-4-(4-phenylpiperazino)triazolo[4,5-b][1,5]benzoxazepine
CAS Registry Number 106157-57-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23ClN6O
InChI InChI=1S/C26H23ClN6O/c27-20-12-10-19(11-13-20)18-33-26-24(29-30-33)25(28-22-8-4-5-9-23(22)34-26)32-16-14-31(15-17-32)21-6-2-1-3-7-21/h1-13H,14-18H2
InChIKey LZZXTQXOGOYFDN-UHFFFAOYSA-N
Molecular Weight 470.964 g/mol
SMILES c12c([n](Cc3ccc(cc3)Cl)nn1)Oc1ccccc1N=C2N1CCN(CC1)c1ccccc1
SPLASH splash10-0ug0-1509100000-bb45caba162462b1c91c
Source of Spectrum Y-22-1698-0
Synonyms 1-[(4-chlorophenyl)methyl]-4-(4-phenyl-1-piperazinyl)triazolo[4,5-b][1,5]benzoxazepine 1-[(4-chlorophenyl)methyl]-4-(4-phenylpiperazin-1-yl)-[1,2,3]triazolo[4,5-b][1,5]benzoxazepine 1-[(4-chlorophenyl)methyl]-4-(4-phenylpiperazin-1-yl)triazolo[4,5-b][1,5]benzoxazepine
Wiley ID 1392815