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2,2,5-trimethyl-5-(3-methylbut-2-enyl)-1,3-dioxane-4,6-dione
SpectraBase Compound ID BwDERB0iIlU
InChI InChI=1S/C12H18O4/c1-8(2)6-7-12(5)9(13)15-11(3,4)16-10(12)14/h6H,7H2,1-5H3
InChIKey CRTNQRORJQEGPZ-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wn6MVcJVo
Name 2,2,5-trimethyl-5-(3-methylbut-2-enyl)-1,3-dioxane-4,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-8(2)6-7-12(5)9(13)15-11(3,4)16-10(12)14/h6H,7H2,1-5H3
InChIKey CRTNQRORJQEGPZ-UHFFFAOYSA-N
Molecular Weight 226.272 g/mol
SMILES C1(OC(C(C(O1)=O)(C)CC=C(C)C)=O)(C)C
SPLASH splash10-01t9-2930000000-82656e147df4bff28a8a
Source of Spectrum O1-65-1920-3
Synonyms 2,2,5-trimethyl-5-(3-methylbut-2-enyl)-1,3-dioxane-4,6-quinone
Wiley ID 1593245