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2,5-dimethylfuran-3-carboxylic acid ethyl ester
SpectraBase Compound ID HypnTU7q7rN
InChI InChI=1S/C9H12O3/c1-4-11-9(10)8-5-6(2)12-7(8)3/h5H,4H2,1-3H3
InChIKey DNYLSCDHFCSDRM-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 AzdlN71llom
Name 3-Furancarboxylic acid, 2,5-dimethyl-, ethyl ester
CAS Registry Number 29113-63-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-4-11-9(10)8-5-6(2)12-7(8)3/h5H,4H2,1-3H3
InChIKey DNYLSCDHFCSDRM-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES c1(c(oc(c1)C)C)C(=O)OCC
SPLASH splash10-00rf-4900000000-aec634411fbfc62b6700
Source of Spectrum I-53-1502-0
Synonyms 2,5-Dimethyl-3-furancarboxylic acid ethyl ester 2,5-Dimethylfuran-3-carboxylic acid ethyl ester Ethyl 2,5-dimethyl-3-furoate Ethyl 2,5-dimethylfuran-3-carboxylate
Wiley ID 1164278