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5-(Ethylsulfanyl)-4-formyl-2-thiophenecarboxylic acid
SpectraBase Compound ID BuNeukew6s6
InChI InChI=1S/C8H8O3S2/c1-2-12-8-5(4-9)3-6(13-8)7(10)11/h3-4H,2H2,1H3,(H,10,11)
InChIKey IQZIBCVTAZLDAQ-UHFFFAOYSA-N
Mol Weight 216.27 g/mol
Molecular Formula C8H8O3S2
Exact Mass 215.991486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8o9H11eX9C
Name 5-(Ethylsulfanyl)-4-formyl-2-thiophenecarboxylic acid
Alternate Name(s) 5-(ethylthio)-4-formyl-2-thenoic acid 5-(ethylthio)-4-formyl-2-thiophenecarboxylic acid 5-Ethylsulfanyl-4-formyl-thiophene-2-carboxylic acid 5-Ethylsulfanyl-4-methanoyl-thiophene-2-carboxylic acid Thiophene-2-carboxylic acid, 5-ethylthio-4-formyl-
CAS Registry Number 57555-46-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O3S2
InChI InChI=1S/C8H8O3S2/c1-2-12-8-5(4-9)3-6(13-8)7(10)11/h3-4H,2H2,1H3,(H,10,11)
InChIKey IQZIBCVTAZLDAQ-UHFFFAOYSA-N
Molecular Weight 216.269 g/mol
SMILES OC(c1cc(c(s1)SCC)C=O)=O
SPLASH splash10-01bi-8910000000-14843d8adfdee7f3fc19
Source of Spectrum AD-0-2532-0
Wiley ID 1424306