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2H-Pyran-2-one, 3,6-dimethyl-
SpectraBase Compound ID GMOlGwZ1vNd
InChI InChI=1S/C7H8O2/c1-5-3-4-6(2)9-7(5)8/h3-4H,1-2H3
InChIKey LTLJMIDAHYUFMI-UHFFFAOYSA-N
Mol Weight 124.14 g/mol
Molecular Formula C7H8O2
Exact Mass 124.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7y6lOLD6KPg
Name 2H-Pyran-2-one, 3,6-dimethyl-
Alternate Name(s) 3,6-Dimethyl-.alpha.-pyrone 3,6-Dimethyl-2-pyrone 3,6-Dimethyl-2H-pyran-2-one Sorbic acid, 5-hydroxy-2-methyl-, .delta.-lactone 3,6-Dimethyl-2H-pyran -2-one 3,6-Dimethyl-2-pyranone
CAS Registry Number 53034-20-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8O2
InChI InChI=1S/C7H8O2/c1-5-3-4-6(2)9-7(5)8/h3-4H,1-2H3
InChIKey LTLJMIDAHYUFMI-UHFFFAOYSA-N
Molecular Weight 124.139 g/mol
SMILES C1(OC(C)=CC=C1C)=O
SPLASH splash10-01bd-9200000000-0c925d86b697965d343b
Source of Spectrum J-49-4529-0
Wiley ID 1128727