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3-Bromo-5-(2-ethoxycarbonylallyl)thiophene-2-carboxylic acid
SpectraBase Compound ID WaKQD6uvkE
InChI InChI=1S/C11H11BrO4S/c1-3-16-11(15)6(2)4-7-5-8(12)9(17-7)10(13)14/h5H,2-4H2,1H3,(H,13,14)
InChIKey GGSPPFCCVKZQRN-UHFFFAOYSA-N
Mol Weight 319.17 g/mol
Molecular Formula C11H11BrO4S
Exact Mass 317.956143 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LCDgCcAIJC
Name 3-Bromo-5-(2-ethoxycarbonylallyl)thiophene-2-carboxylic acid
Alternate Name(s) 3-Bromo-5-[2-(ethoxycarbonyl)-2-propenyl]-2-thiophenecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11BrO4S
InChI InChI=1S/C11H11BrO4S/c1-3-16-11(15)6(2)4-7-5-8(12)9(17-7)10(13)14/h5H,2-4H2,1H3,(H,13,14)
InChIKey GGSPPFCCVKZQRN-UHFFFAOYSA-N
Molecular Weight 319.169 g/mol
SMILES OC(c1c(cc(s1)CC(=C)C(=O)OCC)Br)=O
SPLASH splash10-014i-0096000000-52831f2786e8aedf6969
Source of Spectrum J-65-4634-36
Wiley ID 1532863