For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

5-tert-Butyl-perhydro-isobenzofuranone

View entire compound with spectra: 1 MS (GC)

5-tert-Butyl-perhydro-isobenzofuranone
SpectraBase Compound ID 37BBY1B3ZRD
InChI InChI=1S/C12H20O2/c1-12(2,3)9-4-5-10-8(6-9)7-14-11(10)13/h8-10H,4-7H2,1-3H3
InChIKey CMCQDWZUCSMCQC-UHFFFAOYSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5m0dPmQY00F
Name 5-tert-Butyl-perhydro-isobenzofuranone
Alternate Name(s) 5-tert-Butylhexahydro-2-benzofuran-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-12(2,3)9-4-5-10-8(6-9)7-14-11(10)13/h8-10H,4-7H2,1-3H3
InChIKey CMCQDWZUCSMCQC-UHFFFAOYSA-N
Molecular Weight 196.290 g/mol
SMILES C1(OCC2CC(CCC12)C(C)(C)C)=O
SPLASH splash10-0a4l-9300000000-14085d71791981b262c8
Source of Spectrum QE-5-1043-4
Wiley ID 844112