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2-{2-[(Benzyloxy)methyl]-1,3-dithian-2-yl}-1,1-diethoxypropan-2-one
SpectraBase Compound ID EzS96YlgDIO
InChI InChI=1S/C19H28O4S2/c1-3-22-18(23-4-2)17(20)13-19(24-11-8-12-25-19)15-21-14-16-9-6-5-7-10-16/h5-7,9-10,18H,3-4,8,11-15H2,1-2H3
InChIKey HHCHSTVRUIDKKO-UHFFFAOYSA-N
Mol Weight 384.55 g/mol
Molecular Formula C19H28O4S2
Exact Mass 384.142902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E4rO1eacgDn
Name 2-{2-[(Benzyloxy)methyl]-1,3-dithian-2-yl}-1,1-diethoxypropan-2-one
Alternate Name(s) 3-(2-((benzyloxy)methyl)-1,3-dithian-2-yl)-1,1-diethoxypropan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O4S2
InChI InChI=1S/C19H28O4S2/c1-3-22-18(23-4-2)17(20)13-19(24-11-8-12-25-19)15-21-14-16-9-6-5-7-10-16/h5-7,9-10,18H,3-4,8,11-15H2,1-2H3
InChIKey HHCHSTVRUIDKKO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201200423
Molecular Weight 384.549 g/mol
SMILES C(c1ccccc1)OCC1(SCCCS1)CC(C(OCC)OCC)=O
SPLASH splash10-0udl-9700000000-fc747c7b0f4663c92801
Source of Spectrum H-95-2115-11a_Bn
Wiley ID 1784201