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10-(4-chlorophenyl)-14,14-dimethyl-2,7,9-triazatricyclo[9.4.0.0(3,8)]pentadeca-1(11),3(8),4,6-tetraen-12-one
SpectraBase Compound ID 1H7nIFcL5Wf
InChI InChI=1S/C20H20ClN3O/c1-20(2)10-15-17(16(25)11-20)18(12-5-7-13(21)8-6-12)24-19-14(23-15)4-3-9-22-19/h3-9,18,23H,10-11H2,1-2H3,(H,22,24)
InChIKey DKKGFEVSGMVPOR-UHFFFAOYSA-N
Mol Weight 353.85 g/mol
Molecular Formula C20H20ClN3O
Exact Mass 353.12949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8xGP7NqyjhD
Name 10-(4-chlorophenyl)-14,14-dimethyl-2,7,9-triazatricyclo[9.4.0.0(3,8)]pentadeca-1(11),3(8),4,6-tetraen-12-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20ClN3O
InChI InChI=1S/C20H20ClN3O/c1-20(2)10-15-17(16(25)11-20)18(12-5-7-13(21)8-6-12)24-19-14(23-15)4-3-9-22-19/h3-9,18,23H,10-11H2,1-2H3,(H,22,24)
InChIKey DKKGFEVSGMVPOR-UHFFFAOYSA-N
Molecular Weight 353.853 g/mol
SMILES N1c2c(NC(C=3C(=O)CC(C)(C)CC13)c1ccc(cc1)Cl)nccc2
SPLASH splash10-0006-0292000000-9aa518f03feabc4a45e9
Source of Spectrum IY-2-4975-1
Synonyms 9H-Pyrido[3,2-b][1,4]benzodiazepin-9-one, 10-(4-chlorophenyl)-5,6,7,8,10,11-hexahydro-7,7-dimethyl-
Wiley ID 1657734