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5-(1-oxopropyl)-2-thiophenecarboxylic acid
SpectraBase Compound ID FWEHUkD84Lj
InChI InChI=1S/C8H8O3S/c1-2-5(9)6-3-4-7(12-6)8(10)11/h3-4H,2H2,1H3,(H,10,11)
InChIKey FHTWPFYVZRZBJE-UHFFFAOYSA-N
Mol Weight 184.21 g/mol
Molecular Formula C8H8O3S
Exact Mass 184.019415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6diRSaVXfPi
Name 5-(1-oxopropyl)-2-thiophenecarboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C8H8O3S
InChI InChI=1S/C8H8O3S/c1-2-5(9)6-3-4-7(12-6)8(10)11/h3-4H,2H2,1H3,(H,10,11)
InChIKey FHTWPFYVZRZBJE-UHFFFAOYSA-N
Molecular Weight 184.209 g/mol
SMILES OC(c1ccc(s1)C(=O)CC)=O
SPLASH splash10-0a4i-0900000000-f93274d4d2460ad14474
Source of Spectrum J-65-4634-35
Synonyms 5-propanoylthiophene-2-carboxylic acid 5-propionyl-2-thenoic acid
Wiley ID 1532866