| SpectraBase Spectrum ID |
4riJ4VnkoVe |
| Name |
(3S,5R,4R)-3-Hydroxy-5,6-(isopropylidendioxy)-3-(2-methyl-1,3-dithian-2-yl)cyclohexanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H22O4S2 |
| InChI |
InChI=1S/C14H22O4S2/c1-12(2)17-10-8-14(16,7-9(15)11(10)18-12)13(3)19-5-4-6-20-13/h10-11,16H,4-8H2,1-3H3/t10-,11+,14-/m1/s1 |
| InChIKey |
RHSMYTWIPPKZGW-UHIISALHSA-N |
| Literature Reference DOI |
10.1002/cber.19801130528 |
| Molecular Weight |
318.446 g/mol |
| SMILES |
O[C@@]1(CC([C@]2([C@@](C1)(OC(C)(C)O2)[H])[H])=O)C1(SCCCS1)C |
| SPLASH |
splash10-001i-0901000000-5afb7d96b690c7be93c3 |
| Source of Spectrum |
K-113-1941-18 |
| Synonyms |
(3aR,6S,7aR)-6-hydroxy-2,2-dimethyl-6-(2-methyl-1,3-dithian-2-yl)tetrahydrobenzo[d][1,3]dioxol-4(3aH)-one |
| Wiley ID |
1792733 |
