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8-(2-methylbutyl)-1,5-benzodioxepin-3-one

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8-(2-methylbutyl)-1,5-benzodioxepin-3-one
SpectraBase Compound ID FpVXVm5VZPT
InChI InChI=1S/C14H18O3/c1-3-10(2)6-11-4-5-13-14(7-11)17-9-12(15)8-16-13/h4-5,7,10H,3,6,8-9H2,1-2H3
InChIKey IALLGZHDBYADNH-UHFFFAOYSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LdnVjx0E4PA
Name 8-(2-methylbutyl)-1,5-benzodioxepin-3-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-3-10(2)6-11-4-5-13-14(7-11)17-9-12(15)8-16-13/h4-5,7,10H,3,6,8-9H2,1-2H3
InChIKey IALLGZHDBYADNH-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 234.295 g/mol
Source File Reference MHKO25470