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Ethyl 6-(2-thienyl)-2,4,6-trioxohexanoate
SpectraBase Compound ID 9emwGpO0U1b
InChI InChI=1S/C12H12O5S/c1-2-17-12(16)10(15)7-8(13)6-9(14)11-4-3-5-18-11/h3-5H,2,6-7H2,1H3
InChIKey IMTNINLMSBGSHE-UHFFFAOYSA-N
Mol Weight 268.28 g/mol
Molecular Formula C12H12O5S
Exact Mass 268.040545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41lHZz2Ft6k
Name Ethyl 6-(2-thienyl)-2,4,6-trioxohexanoate
Alternate Name(s) Ethyl 2,4,6-trioxo-6-(2-thienyl)hexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O5S
InChI InChI=1S/C12H12O5S/c1-2-17-12(16)10(15)7-8(13)6-9(14)11-4-3-5-18-11/h3-5H,2,6-7H2,1H3
InChIKey IMTNINLMSBGSHE-UHFFFAOYSA-N
Molecular Weight 268.283 g/mol
SMILES C(C(CC(CC(=O)c1cccs1)=O)=O)(=O)OCC
SPLASH splash10-0292-1910000000-81c6743aca0a71929592
Source of Spectrum Y1-39-194-3
Wiley ID 1527948