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3-Acetyl-1-iodo-2,2-dimethylcyclobutane
SpectraBase Compound ID FebNbd5lBgC
InChI InChI=1S/C8H13IO/c1-5(10)6-4-7(9)8(6,2)3/h6-7H,4H2,1-3H3/t6-,7?/m1/s1
InChIKey CTTJTKGDOQECAV-ULUSZKPHSA-N
Mol Weight 252.1 g/mol
Molecular Formula C8H13IO
Exact Mass 252.00111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pQ9cF69PYX
Name 3-Acetyl-1-iodo-2,2-dimethylcyclobutane
Alternate Name(s) 1-((S)-3-Iodo-2,2-dimethyl-cyclobutyl)-ethanone 1-(3-iodo-2,2-dimethylcyclobutyl)ethanone 1-[(1S)-3-iodo-2,2-dimethylcyclobutyl]ethanone 1-[(1S)-3-iodanyl-2,2-dimethyl-cyclobutyl]ethanone
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Formula C8H13IO
InChI InChI=1S/C8H13IO/c1-5(10)6-4-7(9)8(6,2)3/h6-7H,4H2,1-3H3/t6-,7?/m1/s1
InChIKey CTTJTKGDOQECAV-ULUSZKPHSA-N
Molecular Weight 252.095 g/mol
SMILES C1([C@@](C(=O)C)(CC1I)[H])(C)C
SPLASH splash10-000x-9000000000-55cced21dd5d53b2ae42
Source of Spectrum SK-26-1963-10
Wiley ID 867048