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(2S,3R,4S,5R)-4-Benzyloxy-5-(1,3-dithian-2-yl)-3,5-(4-methoxybenzylidenedioxy)-1,2-epoxypentane
SpectraBase Compound ID 9twfS6gVGLC
InChI InChI=1S/C24H28O5S2/c1-25-18-10-8-17(9-11-18)23-28-20(19-15-26-19)21(27-14-16-6-3-2-4-7-16)22(29-23)24-30-12-5-13-31-24/h2-4,6-11,19-24H,5,12-15H2,1H3/t19-,20+,21-,22+,23+/m1/s1
InChIKey VLYOCNIUWHAZFX-LILXYRQWSA-N
Mol Weight 460.6 g/mol
Molecular Formula C24H28O5S2
Exact Mass 460.137816 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HZs99uk2gPc
Name (2S,3R,4S,5R)-4-Benzyloxy-5-(1,3-dithian-2-yl)-3,5-(4-methoxybenzylidenedioxy)-1,2-epoxypentane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.137816345 u
Formula C24H28O5S2
InChI InChI=1S/C24H28O5S2/c1-25-18-10-8-17(9-11-18)23-28-20(19-15-26-19)21(27-14-16-6-3-2-4-7-16)22(29-23)24-30-12-5-13-31-24/h2-4,6-11,19-24H,5,12-15H2,1H3/t19-,20+,21-,22+,23+/m1/s1
InChIKey VLYOCNIUWHAZFX-LILXYRQWSA-N
Molecular Weight 460.603 g/mol
SMILES [C@@]1([C@@]([C@]([C@@]2(OC2)[H])(O[C@@](O1)(C=1C=CC(=CC1)OC)[H])[H])(OCC=1C=CC=CC1)[H])(C1SCCCS1)[H]