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2-[2'-(4''-Methoxybenzyloxy)-3'-methylpentyl)-1,3-dithiane
SpectraBase Compound ID DZ9N31gOa2E
InChI InChI=1S/C18H28O2S2/c1-4-14(2)17(12-18-21-10-5-11-22-18)20-13-15-6-8-16(19-3)9-7-15/h6-9,14,17-18H,4-5,10-13H2,1-3H3/t14-,17+/m0/s1
InChIKey VCCNUJQKJWLROO-WMLDXEAASA-N
Mol Weight 340.54 g/mol
Molecular Formula C18H28O2S2
Exact Mass 340.153072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vC3RaWgiAS
Name 2-[2'-(4''-Methoxybenzyloxy)-3'-methylpentyl)-1,3-dithiane
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O2S2
InChI InChI=1S/C18H28O2S2/c1-4-14(2)17(12-18-21-10-5-11-22-18)20-13-15-6-8-16(19-3)9-7-15/h6-9,14,17-18H,4-5,10-13H2,1-3H3/t14-,17+/m0/s1
InChIKey VCCNUJQKJWLROO-WMLDXEAASA-N
Molecular Weight 340.540 g/mol
SMILES C(C1SCCCS1)[C@@](OCc1ccc(cc1)OC)([C@](CC)(C)[H])[H]
SPLASH splash10-00lr-0960000000-c3b1d9e0483c2d8dff2e
Source of Spectrum Y-38-168-13
Synonyms 2-{(2R,3S)-2-[(4-methoxybenzyl)oxy]-3-methylpentyl}-1,3-dithiane 2-[(2R,3S)-2-[(4-methoxyphenyl)methoxy]-3-methylpentyl]-1,3-dithiane 2-[(2R,3S)-2-[(4-methoxyphenyl)methoxy]-3-methyl-pentyl]-1,3-dithiane
Wiley ID 848303