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Propanoic acid, 3-(benzoylthio)-2-(phenylseleno)-, methyl ester
SpectraBase Compound ID 4abDDrHAYsb
InChI InChI=1S/C17H16O3SSe/c1-19-16(18)15(22-14-10-6-3-7-11-14)12-20-17(21)13-8-4-2-5-9-13/h2-11,15H,12H2,1H3
InChIKey DCGUSNUFQPQABP-UHFFFAOYSA-N
Mol Weight 379.34 g/mol
Molecular Formula C17H16O3SSe
Exact Mass 379.998538 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GY8daJEnYSq
Name Propanoic acid, 3-(benzoylthio)-2-(phenylseleno)-, methyl ester
Alternate Name(s) Methyl 2-phenylseleno-3-thiobenzoyloxypropionate Methyl 3-(benzothioyloxy)-2-(phenylselanyl)propanoate
CAS Registry Number 127801-28-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O3SSe
InChI InChI=1S/C17H16O3SSe/c1-19-16(18)15(22-14-10-6-3-7-11-14)12-20-17(21)13-8-4-2-5-9-13/h2-11,15H,12H2,1H3
InChIKey DCGUSNUFQPQABP-UHFFFAOYSA-N
Molecular Weight 379.344 g/mol
SMILES C(C(=O)OC)([Se]c1ccccc1)COC(=S)c1ccccc1
SPLASH splash10-0a4i-0900000000-018a408ba19f5146e6f2
Source of Spectrum KC-1989-1929-3
Wiley ID 1359529