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3-(2,3,4,5,6-Pentafluorophenyl)propanal
SpectraBase Compound ID XhrSluZGu8
InChI InChI=1S/C9H5F5O/c10-5-4(2-1-3-15)6(11)8(13)9(14)7(5)12/h3H,1-2H2
InChIKey MWGBJPJOEPVDDN-UHFFFAOYSA-N
Mol Weight 224.13 g/mol
Molecular Formula C9H5F5O
Exact Mass 224.026056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqtddDKUoPU
Name 3-(2,3,4,5,6-Pentafluorophenyl)propanal
Alternate Name(s) 3-(2,3,4,5,6-Pentafluorophenyl)propionaldehyde 3-[2,3,4,5,6-Pentakis(fluoranyl)phenyl]propanal
CAS Registry Number 82208-42-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H5F5O
InChI InChI=1S/C9H5F5O/c10-5-4(2-1-3-15)6(11)8(13)9(14)7(5)12/h3H,1-2H2
InChIKey MWGBJPJOEPVDDN-UHFFFAOYSA-N
Molecular Weight 224.130 g/mol
SMILES c1(c(c(F)c(c(c1F)F)CCC=O)F)F
SPLASH splash10-001i-0910000000-fe83d4e0ff9d9ccc5845
Source of Spectrum C-109-7719-0
Wiley ID 1224494