| SpectraBase Spectrum ID |
L4HgTAHgMNp |
| Name |
(1S,3R,4R,5R)-3-Acetoxy-4,5-(isopropylidendioxy)-1-(2-methyl-1,3-dithian-2-yl)cyclohexanol |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H26O5S2 |
| InChI |
InChI=1S/C16H26O5S2/c1-10(17)19-11-8-16(18,15(4)22-6-5-7-23-15)9-12-13(11)21-14(2,3)20-12/h11-13,18H,5-9H2,1-4H3/t11-,12-,13+,16-/m1/s1 |
| InChIKey |
NGFANVLRWFUMDZ-NFFDBFGFSA-N |
| Literature Reference DOI |
10.1002/cber.19801130528 |
| Molecular Weight |
362.499 g/mol |
| SMILES |
O[C@@]1(C[C@]([C@]2([C@@](C1)(OC(C)(C)O2)[H])[H])(OC(=O)C)[H])C1(SCCCS1)C |
| SPLASH |
splash10-001i-0900000000-14cc382ab4ccb857401a |
| Source of Spectrum |
K-113-1939-11 |
| Synonyms |
(3aR,4R,6S,7aR)-6-hydroxy-2,2-dimethyl-6-(2-methyl-1,3-dithian-2-yl)hexahydrobenzo[d][1,3]dioxol-4-yl acetate |
| Wiley ID |
1792727 |
