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3-[2-(2-Iodo-4,4-dimethylcyclobut-1-yl)ethyl]-3-methyl-2-oxacyclohexanone
SpectraBase Compound ID 1j2tLp47Mdg
InChI InChI=1S/C14H23IO2/c1-13(2)9-11(15)10(13)6-8-14(3)7-4-5-12(16)17-14/h10-11H,4-9H2,1-3H3
InChIKey AZNRLQBYRVKAFK-UHFFFAOYSA-N
Mol Weight 350.24 g/mol
Molecular Formula C14H23IO2
Exact Mass 350.074275 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29GCRWPQdvd
Name 3-[2-(2-Iodo-4,4-dimethylcyclobut-1-yl)ethyl]-3-methyl-2-oxacyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H23IO2
InChI InChI=1S/C14H23IO2/c1-13(2)9-11(15)10(13)6-8-14(3)7-4-5-12(16)17-14/h10-11H,4-9H2,1-3H3
InChIKey AZNRLQBYRVKAFK-UHFFFAOYSA-N
Molecular Weight 350.240 g/mol
SMILES C1(C(CCC2(OC(=O)CCC2)C)C(C1)I)(C)C
SPLASH splash10-0002-9100000000-a7a35bed2b6f035d3c56
Source of Spectrum KC-0-79-42
Synonyms 3-[2-(2-Iodo-4,4-dimethylcyclobut-2-yl)ethyl]-3-methyl-2-oxacyclohexanone 6-[2-(4-iodo-2,2-dimethylcyclobutyl)ethyl]-6-methyltetrahydro-2H-pyran-2-one
Wiley ID 782893