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6,8-Dioxabicyclo[3.2.1]octan-3-one, 5-methyl-1-phenyl-
SpectraBase Compound ID GP3x1QeuH4X
InChI InChI=1S/C13H14O3/c1-12-7-11(14)8-13(16-12,9-15-12)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChIKey JHIJFTFLTBMQRN-UHFFFAOYSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5EE1TJflbn
Name 6,8-Dioxabicyclo[3.2.1]octan-3-one, 5-methyl-1-phenyl-
CAS Registry Number 97149-41-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-12-7-11(14)8-13(16-12,9-15-12)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChIKey JHIJFTFLTBMQRN-UHFFFAOYSA-N
Molecular Weight 218.252 g/mol
SMILES C12(OC(C)(OC2)CC(C1)=O)c1ccccc1
SPLASH splash10-0a4l-4900000000-848dc8c0793e58fff52f
Source of Spectrum KC-1985-286-4
Synonyms 5-Methyl-1-phenyl-6,8-dioxabicyclo[3.2.1]octan-3-one
Wiley ID 1217738