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syn-2,5,5-trimethyl-2-[3-(phenylthio)propyl]tetrahydrofuran-3-ol
SpectraBase Compound ID 78hBOyFqxzh
InChI InChI=1S/C16H24O2S/c1-15(2)12-14(17)16(3,18-15)10-7-11-19-13-8-5-4-6-9-13/h4-6,8-9,14,17H,7,10-12H2,1-3H3/t14-,16-/m0/s1
InChIKey VLMHIQJMXBHIPB-HOCLYGCPSA-N
Mol Weight 280.43 g/mol
Molecular Formula C16H24O2S
Exact Mass 280.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Sgrnsyy5KB
Name syn-2,5,5-trimethyl-2-[3-(phenylthio)propyl]tetrahydrofuran-3-ol
Alternate Name(s) (2S,3S)-2,5,5-Trimethyl-2-(3-phenylsulfanyl-propyl)-tetrahydro-furan-3-ol 1,4-anhydro-2,5-dideoxy-1,1-dimethyl-4-[3-(phenylsulfanyl)propyl]pentitol 2-[3'-(Phenylthio)propyl]3-hydroxy-2,5,5-trimethyl-tetrahydrofuran
Comments Less than 3 mono-isotopic peaks
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Formula C16H24O2S
InChI InChI=1S/C16H24O2S/c1-15(2)12-14(17)16(3,18-15)10-7-11-19-13-8-5-4-6-9-13/h4-6,8-9,14,17H,7,10-12H2,1-3H3/t14-,16-/m0/s1
InChIKey VLMHIQJMXBHIPB-HOCLYGCPSA-N
Molecular Weight 280.426 g/mol
SMILES O[C@@]1([C@@](OC(C1)(C)C)(CCCSc1ccccc1)C)[H]
SPLASH splash10-03di-0900000000-98b345989023875cf941
Source of Spectrum HE-1999-1218-28
Wiley ID 1613507