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5-(tert-Butyl)-4,5,6,7-tetrahydro-3-methyl-1(3H)isobenzofuranone
SpectraBase Compound ID 9mOxGnhzPtW
InChI InChI=1S/C13H20O2/c1-8-11-7-9(13(2,3)4)5-6-10(11)12(14)15-8/h8-9H,5-7H2,1-4H3
InChIKey KWIAWYBPTSERQT-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FzG0H22eA1s
Name 5-(tert-Butyl)-4,5,6,7-tetrahydro-3-methyl-1(3H)isobenzofuranone
Alternate Name(s) 5-(tert-butyl)-3-methyl-4,5,6,7-tetrahydroisobenzofuran-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-8-11-7-9(13(2,3)4)5-6-10(11)12(14)15-8/h8-9H,5-7H2,1-4H3
InChIKey KWIAWYBPTSERQT-UHFFFAOYSA-N
Literature Reference DOI 10.1002_1521-3897(200010)342_8_791
Molecular Weight 208.301 g/mol
SMILES C1(C=2CCC(CC2C(C)O1)C(C)(C)C)=O
SPLASH splash10-0aor-9710000000-2f994240853400db9a59
Source of Spectrum JF-342-800-6c
Wiley ID 1767088