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4-[methoxy(phenylsulfanyl)methyl]oxan-4-ol
SpectraBase Compound ID 4k0y8jsTeid
InChI InChI=1S/C13H18O3S/c1-15-12(13(14)7-9-16-10-8-13)17-11-5-3-2-4-6-11/h2-6,12,14H,7-10H2,1H3
InChIKey VXWXVDOGVJAVIQ-UHFFFAOYSA-N
Mol Weight 254.34 g/mol
Molecular Formula C13H18O3S
Exact Mass 254.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EzOSMKEAkm1
Name 4-[methoxy(phenylsulfanyl)methyl]oxan-4-ol
Alternate Name(s) 4-[methoxy(phenylsulfanyl)methyl]tetrahydropyran-4-ol 4-[methoxy-(phenylthio)methyl]-4-oxanol 4-[methoxy-(phenylthio)methyl]tetrahydropyran-4-ol
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Formula C13H18O3S
InChI InChI=1S/C13H18O3S/c1-15-12(13(14)7-9-16-10-8-13)17-11-5-3-2-4-6-11/h2-6,12,14H,7-10H2,1H3
InChIKey VXWXVDOGVJAVIQ-UHFFFAOYSA-N
Molecular Weight 254.344 g/mol
SMILES OC1(C(Sc2ccccc2)OC)CCOCC1
SPLASH splash10-0kaj-6960000000-12738ba54929e79ff300
Source of Spectrum KC-0-1907-15
Wiley ID 831161