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3'-Bromoacetophenone
SpectraBase Compound ID IDFCq5D9Fi7
InChI InChI=1S/C8H7BrO/c1-6(10)7-3-2-4-8(9)5-7/h2-5H,1H3
InChIKey JYAQYXOVOHJRCS-UHFFFAOYSA-N
Mol Weight 199.05 g/mol
Molecular Formula C8H7BrO
Exact Mass 197.968028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8IarWUGziEK
Name 3-Bromoacetophenone
CAS Registry Number 2142-63-4
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 197.968027844 u
Formula C8H7BrO
InChI InChI=1S/C8H7BrO/c1-6(10)7-3-2-4-8(9)5-7/h2-5H,1H3
InChIKey JYAQYXOVOHJRCS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 199.047 g/mol
Nominal Mass 198 u
Quality 1000
Retention Index 1291
SMILES C=1(C(=O)C)C=C(C=CC1)Br
SPLASH splash10-0kar-4910000000-e6fad79279a6527cb77d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-Acetyl-3-bromobenzene Ethanone,1-(3-bromophenyl)- m-Bromoacetophenone 1-(3-bromophenyl)ethan-1-one
Technique GC/MS
Wiley ID DD2024_022762