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Methyl 3-Phenylselenomethyl-1-thiacyclohexan-4-one-3-carboxylate
SpectraBase Compound ID 2jjdPPeuZDm
InChI InChI=1S/C14H16O3SSe/c1-17-13(16)14(9-18-8-7-12(14)15)10-19-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3
InChIKey AAYWEPVNKVOELE-UHFFFAOYSA-N
Mol Weight 343.31 g/mol
Molecular Formula C14H16O3SSe
Exact Mass 343.998538 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83oPFnJ9cVZ
Name Methyl 3-Phenylselenomethyl-1-thiacyclohexan-4-one-3-carboxylate
Alternate Name(s) Methyl 4-oxo-3-[(phenylselanyl)methyl]tetrahydro-2H-thiopyran-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O3SSe
InChI InChI=1S/C14H16O3SSe/c1-17-13(16)14(9-18-8-7-12(14)15)10-19-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3
InChIKey AAYWEPVNKVOELE-UHFFFAOYSA-N
Molecular Weight 343.311 g/mol
SMILES C1(C(=O)OC)(C(=O)CCSC1)C[Se]c1ccccc1
SPLASH splash10-0a4l-0903000000-28ba039e726d52d519ef
Source of Spectrum F-47-4857-20
Wiley ID 1337578