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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 6gglGOh9k7F
Name 5-Methyl-1-phenyl-6,8-dioxabicyclo(3.2.1)octan-3-one
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
Ionization Type EI-B
Molecular Weight 218.252 g/mol
SMILES C1(=O)CC2(OC(C1)(CO2)c1ccccc1)C
SPLASH splash10-052f-8900000000-ce3c2802f61dbd17c8d1
Source of Spectrum SRH-2022-4365-0
Wiley ID 1826524