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6-(3-Bromophenyl)-1,8-dimethyl-3,4-dihydro-1,5-benzodiazocin-2(1H)-one
SpectraBase Compound ID ABLPzmNi7P1
InChI InChI=1S/C18H17BrN2O/c1-12-6-7-16-15(10-12)18(13-4-3-5-14(19)11-13)20-9-8-17(22)21(16)2/h3-7,10-11H,8-9H2,1-2H3/b20-18-
InChIKey ODTIDJXMAFBPPD-ZZEZOPTASA-N
Mol Weight 357.25 g/mol
Molecular Formula C18H17BrN2O
Exact Mass 356.052426 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4cBqNTs6D7V
Name 6-(3-Bromophenyl)-1,8-dimethyl-3,4-dihydro-1,5-benzodiazocin-2(1H)-one
CAS Registry Number 76061-55-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17BrN2O
InChI InChI=1S/C18H17BrN2O/c1-12-6-7-16-15(10-12)18(13-4-3-5-14(19)11-13)20-9-8-17(22)21(16)2/h3-7,10-11H,8-9H2,1-2H3/b20-18-
InChIKey ODTIDJXMAFBPPD-ZZEZOPTASA-N
Molecular Weight 357.251 g/mol
SMILES CN1C(=O)CC\N=C\(c2cc(Br)ccc2)c2c1ccc(C)c2
SPLASH splash10-0zi0-3549000000-6e619db610ab0dda63ac
Source of Spectrum W6-1989-36688-28848
Synonyms 6-(3-Bromophenyl)-1,2,3,4-tetrahydro-1,8-dimethyl-1,5-benzodiazocin-2-one
Wiley ID 141337