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5-tert-Butyl-1,3-benzodioxole
SpectraBase Compound ID 8EPFra5SZJu
InChI InChI=1S/C11H14O2/c1-11(2,3)8-4-5-9-10(6-8)13-7-12-9/h4-6H,7H2,1-3H3
InChIKey GKIMVZDPIWPNIU-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KkzILcy8ni
Name 1,3-Benzodioxole, 5-(1,1-dimethylethyl)-
Alternate Name(s) 5-TBBD 5-tert-Butyl-1,3-benzodioxole
CAS Registry Number 7228-36-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-11(2,3)8-4-5-9-10(6-8)13-7-12-9/h4-6H,7H2,1-3H3
InChIKey GKIMVZDPIWPNIU-UHFFFAOYSA-N
Molecular Weight 178.231 g/mol
SMILES c12cc(C(C)(C)C)ccc2OCO1
SPLASH splash10-000i-3900000000-64059752b61110cecfdd
Source of Spectrum A-1-95-1
Wiley ID 1174226