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Sotolone-[13C2]

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General Information
Catalog: BLP-000834
CAS: 156420-66-5
Molecular Formula: C4[13C]2H8O3
Molecular Weight: 130.11

Chemical Structure

Description	Sotolone-[13C2] is the labelled analogue of Sotolone. Sotolone is a strong, very sweet, burnt flavor compound found in alcoholic beverages, coffee products, fenugreek, herbs, and spices.
Synonyms	[13C2]-Sotolone; 4,5-Dimethyl-3-hydroxy-2(5H)-furanone-13C2; [13C2]-3-Hydroxy-4-methyl-2(5H)-Furanone; J-009301; 3-Hydroxy-4-methyl-5-methyl-13C-2(5H)-furanone-5-13C; Sautalone-13C2; Sotolon-13C2; Sotolone-13C2
IUPAC Name	4-hydroxy-3-methyl-2-(1-13C)methyl-(2-13C)2H-furan-5-one
Related CAS	28664-35-9 (unlabelled)
Canonical SMILES	CC1C(=C(C(=O)O1)O)C
InChI	InChI=1S/C6H8O3/c1-3-4(2)9-6(8)5(3)7/h4,7H,1-2H3/i2+1,4+1
InChI Key	UNYNVICDCJHOPO-NDLBAUGKSA-N
Purity	95% (CP); 99% atom 13C
Solubility	Soluble in Chloroform, DMSO
Appearance	Clear Colorless to Pale Yellow Oil
Storage	2-8 °C