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Methyl 4-Phenylselenomethyl-1-thiacyclopentan-3-one-4-carboxylate
SpectraBase Compound ID CIAWSyWvWAq
InChI InChI=1S/C13H14O3SSe/c1-16-12(15)13(8-17-7-11(13)14)9-18-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChIKey RMHVXUYRUNWBRE-UHFFFAOYSA-N
Mol Weight 329.28 g/mol
Molecular Formula C13H14O3SSe
Exact Mass 329.982887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5T1iJIZ9IU5
Name Methyl 4-Phenylselenomethyl-1-thiacyclopentan-3-one-4-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C13H14O3SSe
InChI InChI=1S/C13H14O3SSe/c1-16-12(15)13(8-17-7-11(13)14)9-18-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChIKey RMHVXUYRUNWBRE-UHFFFAOYSA-N
Molecular Weight 329.284 g/mol
SMILES C1(C(=O)OC)(C[Se]c2ccccc2)C(=O)CSC1
SPLASH splash10-00e9-0905000000-4af05b4e7dafda580333
Source of Spectrum F-47-4858-26
Synonyms methyl 4-oxo-3-[(phenylselanyl)methyl]tetrahydro-3-thiophenecarboxylate
Wiley ID 1327449