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8-Bromo-1-butyl-6-phenyl-3,4-dihydro-1,5-benzodiazocin-2(1H)-one
SpectraBase Compound ID 7yJnC9V5GVz
InChI InChI=1S/C20H21BrN2O/c1-2-3-13-23-18-10-9-16(21)14-17(18)20(22-12-11-19(23)24)15-7-5-4-6-8-15/h4-10,14H,2-3,11-13H2,1H3/b22-20-
InChIKey UTTGRPXWQRJCJG-XDOYNYLZSA-N
Mol Weight 385.31 g/mol
Molecular Formula C20H21BrN2O
Exact Mass 384.083726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0YzZYivIeG
Name 8-Bromo-1-butyl-6-phenyl-3,4-dihydro-1,5-benzodiazocin-2(1H)-one
Alternate Name(s) 8-Bromo-1-butyl-1,2,3,4-tetrahydro-6-phenyl-1,5-benzodiazocin-2-one
CAS Registry Number 63594-50-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21BrN2O
InChI InChI=1S/C20H21BrN2O/c1-2-3-13-23-18-10-9-16(21)14-17(18)20(22-12-11-19(23)24)15-7-5-4-6-8-15/h4-10,14H,2-3,11-13H2,1H3/b22-20-
InChIKey UTTGRPXWQRJCJG-XDOYNYLZSA-N
Molecular Weight 385.305 g/mol
SMILES CCCCN1C(=O)CC\N=C\(c2ccccc2)c2c1ccc(Br)c2
SPLASH splash10-01q0-2239000000-e336c597f428b10af440
Source of Spectrum W5-1989-36697-28839
Wiley ID 1361468