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4-Oxo-tetrahydro-3-thiophenecarboxylic acid, methyl ester
SpectraBase Compound ID HM629swpPx9
InChI InChI=1S/C6H8O3S/c1-9-6(8)4-2-10-3-5(4)7/h4H,2-3H2,1H3
InChIKey LEAKUJFYXNILRB-UHFFFAOYSA-N
Mol Weight 160.19 g/mol
Molecular Formula C6H8O3S
Exact Mass 160.019415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KnxJlR9hv6i
Name 3-Thiophenecarboxylic acid, tetrahydro-4-oxo-, methyl ester
CAS Registry Number 2689-68-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8O3S
InChI InChI=1S/C6H8O3S/c1-9-6(8)4-2-10-3-5(4)7/h4H,2-3H2,1H3
InChIKey LEAKUJFYXNILRB-UHFFFAOYSA-N
Molecular Weight 160.187 g/mol
SMILES C1(C(=O)OC)C(=O)CSC1
SPLASH splash10-03di-0900000000-93e8750ea5b43c9ddaa2
Source of Spectrum F-47-4857-24
Synonyms 4-Carbomethoxy-3-thiophanone 4-ketotetrahydrothiophene-3-carboxylic acid methyl ester 4-Oxo-3-thiolanecarboxylic acid methyl ester Methyl 4-oxidanylidenethiolane-3-carboxylate Methyl 4-oxotetrahydro-3-thiophenecarboxylate Methyl 4-oxotetrahydrothiophene-3-carboxylate Methyl 4-oxothiolane-3-carboxylate Methyl tetrahydro-4-oxo-3-thiophenecarboxylate Tetrahydrothiophen-3-one-4-carboxylic acid, methyl ester
Wiley ID 1156417