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2-(1-Hydroxy-1-phenylmethyl)-2-(isopopylthio-thiolane 1-oxide isomer
SpectraBase Compound ID 74IZ39LiMPi
InChI InChI=1S/C14H20O2S2/c1-11(2)17-14(9-6-10-18(14)16)13(15)12-7-4-3-5-8-12/h3-5,7-8,11,13,15H,6,9-10H2,1-2H3
InChIKey WNKWUVGHQUPISB-UHFFFAOYSA-N
Mol Weight 284.43 g/mol
Molecular Formula C14H20O2S2
Exact Mass 284.090472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7WZgvrGuihM
Name 2-(1-Hydroxy-1-phenylmethyl)-2-(isopopylthio-thiolane 1-oxide isomer
Alternate Name(s) 2-(1-Hydroxy-1-phenylmethyl)-2-(isopopylthio)thiolane 1-oxide [2-(isopropylsulfanyl)-1-oxidotetrahydro-2-thienyl](phenyl)methanol
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Formula C14H20O2S2
InChI InChI=1S/C14H20O2S2/c1-11(2)17-14(9-6-10-18(14)16)13(15)12-7-4-3-5-8-12/h3-5,7-8,11,13,15H,6,9-10H2,1-2H3
InChIKey WNKWUVGHQUPISB-UHFFFAOYSA-N
Molecular Weight 284.432 g/mol
SMILES OC(C1(S(=O)CCC1)SC(C)C)c1ccccc1
SPLASH splash10-03di-1910000000-28225592163f841c4548
Source of Spectrum F-53-2471-7
Wiley ID 800733