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5,6,7,8-Tetrahydro-2,2-dimethyl-8-(4'-pentenyl)-4H-1,3-benzodioxin-4-one
SpectraBase Compound ID I75BfIaOeXi
InChI InChI=1S/C15H22O3/c1-4-5-6-8-11-9-7-10-12-13(11)17-15(2,3)18-14(12)16/h4,11H,1,5-10H2,2-3H3
InChIKey VFVJCWNCXSOCKJ-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Iim37nvimj
Name 5,6,7,8-Tetrahydro-2,2-dimethyl-8-(4'-pentenyl)-4H-1,3-benzodioxin-4-one
Alternate Name(s) 2,2-Dimethyl-8-(4-pentenyl)-5,6,7,8-tetrahydro-4H-1,3-benzodioxin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-4-5-6-8-11-9-7-10-12-13(11)17-15(2,3)18-14(12)16/h4,11H,1,5-10H2,2-3H3
InChIKey VFVJCWNCXSOCKJ-UHFFFAOYSA-N
Molecular Weight 250.338 g/mol
SMILES C12=C(OC(OC2=O)(C)C)C(CCCC=C)CCC1
SPLASH splash10-00du-0900000000-2a3801103693f4c3d7f9
Source of Spectrum C-113-8843-3
Wiley ID 1253703