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6-Methyl-2-(phenylthio)-2,3-dihydro-1,4-oxathiin-5-carboxylic acid methyl ester
SpectraBase Compound ID 40lfIUsXLif
InChI InChI=1S/C13H14O3S2/c1-9-12(13(14)15-2)17-8-11(16-9)18-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3
InChIKey ZQCKPFNAOFFDFK-UHFFFAOYSA-N
Mol Weight 282.37 g/mol
Molecular Formula C13H14O3S2
Exact Mass 282.038437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pa8npneho0
Name 6-Methyl-2-(phenylthio)-2,3-dihydro-1,4-oxathiin-5-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3S2
InChI InChI=1S/C13H14O3S2/c1-9-12(13(14)15-2)17-8-11(16-9)18-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3
InChIKey ZQCKPFNAOFFDFK-UHFFFAOYSA-N
Molecular Weight 282.372 g/mol
SMILES C1(=C(OC(CS1)Sc1ccccc1)C)C(=O)OC
SPLASH splash10-001c-8950000000-be15cebd1e88b35c0ad1
Source of Spectrum J-60-6424-13
Synonyms Methyl 6-methyl-2-phenylsulfanyl-2,3-dihydro-1,4-oxathiine-5-carboxylate
Wiley ID 1285472