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2-[(1R)-(2,2-Dimethyl(4H-benzo[3,4-e]1,3-dioxin-6-yl)hydroxymethyl]-(1R,3R)-1,3-dithiane 1,3-dioxide
SpectraBase Compound ID Ckxjgh3kyE4
InChI InChI=1S/C15H20O5S2/c1-15(2)19-9-11-8-10(4-5-12(11)20-15)13(16)14-21(17)6-3-7-22(14)18/h4-5,8,13-14,16H,3,6-7,9H2,1-2H3/t13-,14?,21?,22?/m1/s1
InChIKey AWNBQJCTWZIFNT-ROMXVQBMSA-N
Mol Weight 344.44 g/mol
Molecular Formula C15H20O5S2
Exact Mass 344.075216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AucL5cbORMa
Name 2-[(1R)-(2,2-Dimethyl(4H-benzo[3,4-e]1,3-dioxin-6-yl)hydroxymethyl]-(1R,3R)-1,3-dithiane 1,3-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O5S2
InChI InChI=1S/C15H20O5S2/c1-15(2)19-9-11-8-10(4-5-12(11)20-15)13(16)14-21(17)6-3-7-22(14)18/h4-5,8,13-14,16H,3,6-7,9H2,1-2H3/t13-,14?,21?,22?/m1/s1
InChIKey AWNBQJCTWZIFNT-ROMXVQBMSA-N
Molecular Weight 344.440 g/mol
SMILES O[C@@](C1S(=O)CCCS1=O)(c1cc2COC(Oc2cc1)(C)C)[H]
SPLASH splash10-001l-0911000000-29b7febb6f877fef3965
Source of Spectrum F-67-8620-3
Wiley ID 1571311