| SpectraBase Spectrum ID |
8NgG99xbEJr |
| Name |
(3S,5S,6R)-6-(1',3'-Dithian-2'-yl)-5,6-(isopropylidenedioxy-1-phenylsulfonyl)hexan-3-ol |
| Alternate Name(s) |
(2S)-4-(benzenesulfonyl)-1-[(4S,5R)-5-(1,3-dithian-2-yl)-2,2-dimethyl-1,3-dioxolan-4-yl]butan-2-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H28O5S3 |
| InChI |
InChI=1S/C19H28O5S3/c1-19(2)23-16(17(24-19)18-25-10-6-11-26-18)13-14(20)9-12-27(21,22)15-7-4-3-5-8-15/h3-5,7-8,14,16-18,20H,6,9-13H2,1-2H3/t14-,16+,17-/m1/s1 |
| InChIKey |
VXQNBHYGCGOGKX-HYVNUMGLSA-N |
| Molecular Weight |
432.608 g/mol |
| SMILES |
O[C@@](C[C@]1([C@@](OC(O1)(C)C)(C1SCCCS1)[H])[H])(CCS(=O)(=O)c1ccccc1)[H] |
| SPLASH |
splash10-004i-0090000000-b52cdab6faf8bbf4dd8a |
| Source of Spectrum |
KC-1993-1514-33 |
| Wiley ID |
778163 |
