For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-[(4-bromophenyl)methyl]pentane-2,4-dione
SpectraBase Compound ID KibZVc8hzVg
InChI InChI=1S/C12H13BrO2/c1-8(14)12(9(2)15)7-10-3-5-11(13)6-4-10/h3-6,12H,7H2,1-2H3
InChIKey FJFGDNMLLHUQEQ-UHFFFAOYSA-N
Mol Weight 269.14 g/mol
Molecular Formula C12H13BrO2
Exact Mass 268.009893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FMK2gY14L3f
Name 3-[(4-bromophenyl)methyl]pentane-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13BrO2
InChI InChI=1S/C12H13BrO2/c1-8(14)12(9(2)15)7-10-3-5-11(13)6-4-10/h3-6,12H,7H2,1-2H3
InChIKey FJFGDNMLLHUQEQ-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2014 or Shimadzu GC-MS QP 2010
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202200473
Molecular Weight 269.138 g/mol
SMILES c1c(ccc(c1)Br)CC(C(=O)C)C(C)=O
SPLASH splash10-000f-9300000000-ada4cd6a663970bffb98
Source of Spectrum AJO-11-SM20-5c-d
Wiley ID 1880172