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8-(3-methylpentyl)-1,5-benzodioxepin-3-one

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8-(3-methylpentyl)-1,5-benzodioxepin-3-one
SpectraBase Compound ID 5sSAKFUH3Bd
InChI InChI=1S/C15H20O3/c1-3-11(2)4-5-12-6-7-14-15(8-12)18-10-13(16)9-17-14/h6-8,11H,3-5,9-10H2,1-2H3
InChIKey VFHUXRQVILWMJY-UHFFFAOYSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7GFW3HKtHlP
Name 8-(3-methylpentyl)-1,5-benzodioxepin-3-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-3-11(2)4-5-12-6-7-14-15(8-12)18-10-13(16)9-17-14/h6-8,11H,3-5,9-10H2,1-2H3
InChIKey VFHUXRQVILWMJY-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2008)
Molecular Weight 248.322 g/mol
Source File Reference MHKO17087