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3-(2-Bromo-N-ethylanilino)-5,5-dimethylcyclohex-2-en-1-one
SpectraBase Compound ID G32nhQF8CCK
InChI InChI=1S/C16H20BrNO/c1-4-18(15-8-6-5-7-14(15)17)12-9-13(19)11-16(2,3)10-12/h5-9H,4,10-11H2,1-3H3
InChIKey CDESSNNSEOZENZ-UHFFFAOYSA-N
Mol Weight 322.25 g/mol
Molecular Formula C16H20BrNO
Exact Mass 321.072827 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Xl4H9MgHa5
Name 3-(2-Bromo-N-ethylanilino)-5,5-dimethylcyclohex-2-en-1-one
CAS Registry Number 69083-41-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20BrNO
InChI InChI=1S/C16H20BrNO/c1-4-18(15-8-6-5-7-14(15)17)12-9-13(19)11-16(2,3)10-12/h5-9H,4,10-11H2,1-3H3
InChIKey CDESSNNSEOZENZ-UHFFFAOYSA-N
Molecular Weight 322.246 g/mol
SMILES C1(N(c2c(Br)cccc2)CC)=CC(=O)CC(C1)(C)C
SPLASH splash10-006x-0195000000-48c5f8e1d33e80949013
Source of Spectrum J-44-1239-0
Synonyms 3-[2-bromo(ethyl)anilino]-5,5-dimethyl-2-cyclohexen-1-one
Wiley ID 1320856