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2,2-Dimethyl-5-[(5-methyl-1H-pyrrol-2-yl)methylene]-1,3-dioxane-4,6-dione
SpectraBase Compound ID FAuzzo0PuQh
InChI InChI=1S/C12H13NO4/c1-7-4-5-8(13-7)6-9-10(14)16-12(2,3)17-11(9)15/h4-6,13H,1-3H3
InChIKey UMRWYGDYBBSRTL-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C12H13NO4
Exact Mass 235.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G1Y9vgMWM4j
Name 2,2-Dimethyl-5-[(5-methyl-1H-pyrrol-2-yl)methylene]-1,3-dioxane-4,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO4
InChI InChI=1S/C12H13NO4/c1-7-4-5-8(13-7)6-9-10(14)16-12(2,3)17-11(9)15/h4-6,13H,1-3H3
InChIKey UMRWYGDYBBSRTL-UHFFFAOYSA-N
Molecular Weight 235.239 g/mol
SMILES [nH]1c(ccc1C=C1C(OC(OC1=O)(C)C)=O)C
SPLASH splash10-001i-0910000000-1bb5f1792ae82034f803
Source of Spectrum KC-0-2200-14
Synonyms 2,2-Dimethyl-5-[(5-methyl-1H-pyrrol-2-yl)methylene]-1,3-dioxane-4,6-quinone 2,2-Dimethyl-5-[(5-methyl-1H-pyrrol-2-yl)methylidene]-1,3-dioxane-4,6-dione
Wiley ID 822906