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Ethyl 2,4-dimethyl-3-furoate
SpectraBase Compound ID 2gw5kmsCVN0
InChI InChI=1S/C9H12O3/c1-4-11-9(10)8-6(2)5-12-7(8)3/h5H,4H2,1-3H3
InChIKey UKPBLUSMWYHMCH-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 281L0aXPh6i
Name 3-Furancarboxylic acid, 2,4-dimethyl-, ethyl ester
Alternate Name(s) Ethyl 2,4-dimethyl-3-furoate 2,4-dimethyl-3-furancarboxylic acid ethyl ester 2,4-dimethylfuran-3-carboxylic acid ethyl ester 3-Furoic acid, 2,4-dimethyl-, ethyl ester Ethyl 2,4-dimethylfuran-3-carboxylate
CAS Registry Number 6148-33-0
Comments Less than 3 mono-isotopic peaks
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Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-4-11-9(10)8-6(2)5-12-7(8)3/h5H,4H2,1-3H3
InChIKey UKPBLUSMWYHMCH-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES c1c(c(c(C)o1)C(=O)OCC)C
SPLASH splash10-00xr-0900000000-7694d519da4c336f5108
Source of Spectrum J-64-7526-5
Wiley ID 1531196