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1-Benzyl-4-(4-methylpiperazin-1-yl)triazolo[4,5-b][1,5]benzoxazepine
SpectraBase Compound ID J0Qd7Wcrtxv
InChI InChI=1S/C21H22N6O/c1-25-11-13-26(14-12-25)20-19-21(28-18-10-6-5-9-17(18)22-20)27(24-23-19)15-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3
InChIKey XQXROAVKWZTQPI-UHFFFAOYSA-N
Mol Weight 374.45 g/mol
Molecular Formula C21H22N6O
Exact Mass 374.185509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ft2cC10a3n5
Name 1-Benzyl-4-(4-methylpiperazin-1-yl)triazolo[4,5-b][1,5]benzoxazepine
CAS Registry Number 106157-51-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N6O
InChI InChI=1S/C21H22N6O/c1-25-11-13-26(14-12-25)20-19-21(28-18-10-6-5-9-17(18)22-20)27(24-23-19)15-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3
InChIKey XQXROAVKWZTQPI-UHFFFAOYSA-N
Molecular Weight 374.448 g/mol
SMILES c12c([n](Cc3ccccc3)nn1)Oc1ccccc1N=C2N1CCN(CC1)C
SPLASH splash10-000x-9012000000-c96bd46031adc2efc0f0
Source of Spectrum Y-22-1698-0
Synonyms 1-Benzyl-4-(4-methylpiperazino)triazolo[4,5-b][1,5]benzoxazepine 4-(4-Methyl-1-piperazinyl)-1-(phenylmethyl)triazolo[4,5-b][1,5]benzoxazepine 4-(4-Methylpiperazin-1-yl)-1-(phenylmethyl)-[1,2,3]triazolo[4,5-b][1,5]benzoxazepine
Wiley ID 1356634