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5-tert-Butyl-1-[3-(benzoylmethyl)phenyl]-4,4-dimethyl-2,6,7-trioxabicyclo[3.2.0]heptane
SpectraBase Compound ID 3KbsSbGlIgH
InChI InChI=1S/C24H28O4/c1-21(2,3)24-22(4,5)16-26-23(24,27-28-24)19-13-9-10-17(14-19)15-20(25)18-11-7-6-8-12-18/h6-14H,15-16H2,1-5H3
InChIKey AHNBBJMYMCIGDQ-UHFFFAOYSA-N
Mol Weight 380.48 g/mol
Molecular Formula C24H28O4
Exact Mass 380.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 189bWK1vvl2
Name 5-tert-Butyl-1-[3-(benzoylmethyl)phenyl]-4,4-dimethyl-2,6,7-trioxabicyclo[3.2.0]heptane
Alternate Name(s) 2-[3-(5-tert-butyl-4,4-dimethyl-2,6,7-trioxabicyclo[3.2.0]hept-1-yl)phenyl]-1-phenylethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28O4
InChI InChI=1S/C24H28O4/c1-21(2,3)24-22(4,5)16-26-23(24,27-28-24)19-13-9-10-17(14-19)15-20(25)18-11-7-6-8-12-18/h6-14H,15-16H2,1-5H3
InChIKey AHNBBJMYMCIGDQ-UHFFFAOYSA-N
Molecular Weight 380.484 g/mol
SMILES C12(OCC(C2(OO1)C(C)(C)C)(C)C)c1cc(ccc1)CC(c1ccccc1)=O
SPLASH splash10-00di-0191000000-c83d0aa136005912fcc4
Source of Spectrum KC-61-9580-1
Wiley ID 1630767