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2-Iodo-3-methylcyclohexan-1-one
SpectraBase Compound ID DNCYrVFaSkN
InChI InChI=1S/C7H11IO/c1-5-3-2-4-6(9)7(5)8/h5,7H,2-4H2,1H3
InChIKey ZPJPOAJRDZOLBH-UHFFFAOYSA-N
Mol Weight 238.07 g/mol
Molecular Formula C7H11IO
Exact Mass 237.98546 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Krcte2YkW4g
Name 2-Iodo-3-methylcyclohexan-1-one
Alternate Name(s) 2-iodanyl-3-methyl-cyclohexan-1-one 2-iodo-3-methyl-1-cyclohexanone 2-iodo-3-methyl-cyclohexanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11IO
InChI InChI=1S/C7H11IO/c1-5-3-2-4-6(9)7(5)8/h5,7H,2-4H2,1H3
InChIKey ZPJPOAJRDZOLBH-UHFFFAOYSA-N
Molecular Weight 238.068 g/mol
SMILES C1(C(=O)CCCC1C)I
SPLASH splash10-000i-0190000000-311c1da4643dbc5ba734
Source of Spectrum AT-42-685-12
Wiley ID 854970