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7-Chloro-2-n-butylamino-5-phenyl-3H-1,3,4-benzotriazepine
SpectraBase Compound ID HqmAUOjDJWB
InChI InChI=1S/C18H19ClN4/c1-2-3-11-20-18-21-16-10-9-14(19)12-15(16)17(22-23-18)13-7-5-4-6-8-13/h4-10,12H,2-3,11H2,1H3,(H2,20,21,23)
InChIKey KJBRUGAPMRUCKH-UHFFFAOYSA-N
Mol Weight 326.83 g/mol
Molecular Formula C18H19ClN4
Exact Mass 326.129824 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID At5LwZOxXrP
Name 7-Chloro-2-n-butylamino-5-phenyl-3H-1,3,4-benzotriazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19ClN4
InChI InChI=1S/C18H19ClN4/c1-2-3-11-20-18-21-16-10-9-14(19)12-15(16)17(22-23-18)13-7-5-4-6-8-13/h4-10,12H,2-3,11H2,1H3,(H2,20,21,23)
InChIKey KJBRUGAPMRUCKH-UHFFFAOYSA-N
Molecular Weight 326.831 g/mol
SMILES N1N=C(c2c(N=C1NCCCC)ccc(c2)Cl)c1ccccc1
SPLASH splash10-0059-1094000000-fbf5bf56aa72f89bff05
Source of Spectrum Y-28-1989-8
Synonyms 2-Butylamino-7-chloro-5-phenyl-3H-1,3,4-benzotriazepine N-butyl-7-chloro-5-phenyl-3H-1,3,4-benzotriazepin-2-amine N-butyl-N-(7-chloro-5-phenyl-3H-1,3,4-benzotriazepin-2-yl)amine
Wiley ID 1324779