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(3R)-3-(1,3-dithian-2-yl)-2,2-dimethyl-3-phenylmethoxy-1-propanol
SpectraBase Compound ID HPVNMDXmLhq
InChI InChI=1S/C16H24O2S2/c1-16(2,12-17)14(15-19-9-6-10-20-15)18-11-13-7-4-3-5-8-13/h3-5,7-8,14-15,17H,6,9-12H2,1-2H3/t14-/m0/s1
InChIKey AXVAOYPTGNXORS-AWEZNQCLSA-N
Mol Weight 312.49 g/mol
Molecular Formula C16H24O2S2
Exact Mass 312.121772 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5FjYfIUh2Vc
Name (3R)-3-(1,3-dithian-2-yl)-2,2-dimethyl-3-phenylmethoxy-1-propanol
Alternate Name(s) (3R)-3-(1,3-dithian-2-yl)-2,2-dimethyl-3-phenylmethoxy-propan-1-ol (3R)-3-benzoxy-3-(1,3-dithian-2-yl)-2,2-dimethyl-propan-1-ol (3R)-3-benzyloxy-3-(1,3-dithian-2-yl)-2,2-dimethyl-propan-1-ol
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Formula C16H24O2S2
InChI InChI=1S/C16H24O2S2/c1-16(2,12-17)14(15-19-9-6-10-20-15)18-11-13-7-4-3-5-8-13/h3-5,7-8,14-15,17H,6,9-12H2,1-2H3/t14-/m0/s1
InChIKey AXVAOYPTGNXORS-AWEZNQCLSA-N
Molecular Weight 312.486 g/mol
SMILES OCC([C@](C1SCCCS1)(OCc1ccccc1)[H])(C)C
SPLASH splash10-0006-9300000000-180bcbdc81041a6effd5
Source of Spectrum K-127-1307-6
Wiley ID 1313126