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1,4-Ethano-1H-pyrido[3,2-b][1,5]benzodiazepine, 10-benzoyl-2,3,4,4a,5,10,11,11a-octahydro-
SpectraBase Compound ID 5xLHO2NmBIL
InChI InChI=1S/C21H23N3O/c25-21(16-6-2-1-3-7-16)24-14-19-20(15-10-12-23(19)13-11-15)22-17-8-4-5-9-18(17)24/h1-9,15,19-20,22H,10-14H2
InChIKey OPWYHABVMQCCBC-UHFFFAOYSA-N
Mol Weight 333.44 g/mol
Molecular Formula C21H23N3O
Exact Mass 333.184112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9yi4XW0sET6
Name 1,4-Ethano-1H-pyrido[3,2-b][1,5]benzodiazepine, 10-benzoyl-2,3,4,4a,5,10,11,11a-octahydro-
Alternate Name(s) 1,4-Ethano-1H-pyrido(3,2-b)(1,5)benzodiazepine, 2,3,4,4a,5,10,11,11a-octahydro-10-benzoyl- 10-Benzoyl-4a,5,11,11a-tetrahydro-10H-quinuclidino(2,3-c)-1,5-benzodiazepine 2,3,4,4a,5,10,11,11a-octahydro-10-benzoyl-1,4-ethano-1H-pyrido(3,2-b)(1,5)benzodiazepine
CAS Registry Number 72031-22-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3O
InChI InChI=1S/C21H23N3O/c25-21(16-6-2-1-3-7-16)24-14-19-20(15-10-12-23(19)13-11-15)22-17-8-4-5-9-18(17)24/h1-9,15,19-20,22H,10-14H2
InChIKey OPWYHABVMQCCBC-UHFFFAOYSA-N
Molecular Weight 333.435 g/mol
SMILES N1C2C(CN(c3c1cccc3)C(=O)c1ccccc1)N1CCC2CC1
SPLASH splash10-0a4i-7931000000-28f2d6d1790b54ca9664
Source of Spectrum AD-0-2532-0
Wiley ID 1425759