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1,5-Dimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione
SpectraBase Compound ID JDpHThvn6pO
InChI InChI=1S/C9H12O3/c1-8-3-4-9(2,5-8)7(11)12-6(8)10/h3-5H2,1-2H3
InChIKey ZAKQJECKJGJYGN-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5KgwvXZkxA
Name 1,5-Dimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione
Alternate Name(s) 1,5-Dimethyl-3-oxabicyclo[3.2.1]octane-2,4-quinone
CAS Registry Number 69461-54-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-8-3-4-9(2,5-8)7(11)12-6(8)10/h3-5H2,1-2H3
InChIKey ZAKQJECKJGJYGN-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES C1(OC(C2(CCC1(C2)C)C)=O)=O
SPLASH splash10-001u-9000000000-b885f4b642bc912e4449
Source of Spectrum J-44-1925-0
Wiley ID 1164336