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2-Bromo-4'-chloroacetophenone
SpectraBase Compound ID HPRM960HIso
InChI InChI=1S/C8H6BrClO/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H2
InChIKey FLAYZKKEOIAALB-UHFFFAOYSA-N
Mol Weight 233.49 g/mol
Molecular Formula C8H6BrClO
Exact Mass 231.929056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkhT8Gtr9lo
Name 2-Bromo-4'-chloroacetophenone
CAS Registry Number 536-38-9
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 231.929055512 u
Formula C8H6BrClO
InChI InChI=1S/C8H6BrClO/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H2
InChIKey FLAYZKKEOIAALB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 233.492 g/mol
Nominal Mass 232 u
Quality 999
Retention Index 1524
SMILES C=1(C(CBr)=O)C=CC(=CC1)Cl
SPLASH splash10-000i-2900000000-37be5c21713d3ca88ae2
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-Chlorophenacyl bromide Ethanone,2-bromo-1-(4-chlorophenyl)- 2-Bromo-1-(4-chlorophenyl)ethanone
Technique GC/MS
Wiley ID DD2024_024339