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5-(tert-Butyl)-perhydro-3-methyl-isobenzofuranone
SpectraBase Compound ID BA7z0RXYwZ3
InChI InChI=1S/C13H22O2/c1-8-11-7-9(13(2,3)4)5-6-10(11)12(14)15-8/h8-11H,5-7H2,1-4H3
InChIKey YUKJNODYGBSOFH-UHFFFAOYSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CcNbsLAefqS
Name 5-(tert-Butyl)-perhydro-3-methyl-isobenzofuranone
Alternate Name(s) 5-(tert-butyl)-3-methylhexahydroisobenzofuran-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-8-11-7-9(13(2,3)4)5-6-10(11)12(14)15-8/h8-11H,5-7H2,1-4H3
InChIKey YUKJNODYGBSOFH-UHFFFAOYSA-N
Literature Reference DOI 10.1002_1521-3897(200010)342_8_791
Molecular Weight 210.317 g/mol
SMILES C1(C2CCC(CC2C(C)O1)C(C)(C)C)=O
SPLASH splash10-0a4i-9400000000-7ba5bc2bae8081ae8f4e
Source of Spectrum JF-342-800-8b
Wiley ID 1767090