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2-Pentanone, 5-iodo-3-methyl-, radical ion(1+)
SpectraBase Compound ID 1NCe6Hb8832
InChI InChI=1S/C6H11IO/c1-5(3-4-7)6(2)8/h5H,3-4H2,1-2H3
InChIKey LATRLYBSVIDJHE-UHFFFAOYSA-N
Mol Weight 226.06 g/mol
Molecular Formula C6H11IO
Exact Mass 225.98546 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A81rgl6ajmF
Name 2-Pentanone, 5-iodo-3-methyl-, radical ion(1+)
Alternate Name(s) 3-Methyl-5-iodo-n-pentane-2-one 5-iodo-3-methyl-2-pentanone
CAS Registry Number 72038-64-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11IO
InChI InChI=1S/C6H11IO/c1-5(3-4-7)6(2)8/h5H,3-4H2,1-2H3
InChIKey LATRLYBSVIDJHE-UHFFFAOYSA-N
Molecular Weight 226.057 g/mol
SMILES C(=O)(C(CCI)C)C
SPLASH splash10-052e-9100000000-38a4597531d50f61d58f
Source of Spectrum F-35-363-0
Wiley ID 1226705