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3,4-Dihydro-3,3,5,6,7-pentamethylisocoumarin-4-one
SpectraBase Compound ID 1mfOZpv4n9P
InChI InChI=1S/C14H16O3/c1-7-6-10-11(9(3)8(7)2)12(15)14(4,5)17-13(10)16/h6H,1-5H3
InChIKey QGXRVJDTGOXABU-UHFFFAOYSA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FhmKI6ZVqfO
Name 3,4-Dihydro-3,3,5,6,7-pentamethylisocoumarin-4-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O3
InChI InChI=1S/C14H16O3/c1-7-6-10-11(9(3)8(7)2)12(15)14(4,5)17-13(10)16/h6H,1-5H3
InChIKey QGXRVJDTGOXABU-UHFFFAOYSA-N
Molecular Weight 232.279 g/mol
SMILES c12c(C(=O)OC(C2=O)(C)C)cc(c(c1C)C)C
SPLASH splash10-00e9-0950000000-d6beafca283538f10090
Source of Spectrum F-49-554-9
Synonyms 3,3,5,6,7-pentamethyl-1H-2-benzopyran-1,4(3H)-dione
Wiley ID 1234031