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3,3,4,5-Tetramethyl-2H-pyran-2,6(3H)-dione
SpectraBase Compound ID CN3PrCbrr6u
InChI InChI=1S/C9H12O3/c1-5-6(2)9(3,4)8(11)12-7(5)10/h1-4H3
InChIKey YTQORQSWDQECET-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 BFUJ46yOOLm
Name 3,3,4,5-Tetramethyl-2H-pyran-2,6(3H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-5-6(2)9(3,4)8(11)12-7(5)10/h1-4H3
InChIKey YTQORQSWDQECET-UHFFFAOYSA-N
Instrument Name Micromass Autospec
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.5b00501
Molecular Weight 168.192 g/mol
Reported Formula C9H12O3
SMILES C1(OC(C(C(=C1C)C)(C)C)=O)=O
SPLASH splash10-05ai-9700000000-a6132b709787b6a05a2f
Source of Spectrum G4-79-SM17-7
Wiley ID 1849254