| SpectraBase Spectrum ID |
9UHCfGVLxju |
| Name |
(3aR,4aR,8aS)-Octahydro-6H-spiro{cyclopenta[1,4]cyclobuta[1,2]benzene-5,2'-[1,3]dithiane} |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
254.116293056 u |
| Formula |
C14H22S2 |
| InChI |
InChI=1S/C14H22S2/c1-4-11-10-12-13(11,5-1)6-2-7-14(12)15-8-3-9-16-14/h11-12H,1-10H2/t11-,12-,13+/m1/s1 |
| InChIKey |
VDHFVPGZYKGZBQ-UPJWGTAASA-N |
| Instrument Name |
Agilent MS5977A MSD-Agilent 7890 B |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201700837 |
| Molecular Weight |
254.450 g/mol |
| Quality |
162 |
| Reported Formula |
C14H22S2 |
| SMILES |
C1CCSC2(S1)[C@]1([C@@]3(CCC2)[C@@](C1)(CCC3)[H])[H] |
| SPLASH |
splash10-0ufr-2950000000-915e0b56d17d62c07bbc |
| Source of Spectrum |
ACI-56-SM37-2a (DOI: 10.1002/anie.201700837) |
| Thin-Layer Chromatography |
0.15 (P/Et2O, 99.5:0.5) [KMnO4] |
| Wiley ID |
1895693 |
![(3aR,4aR,8aS)-Octahydro-6H-spiro{cyclopenta[1,4]cyclobuta[1,2]benzene-5,2'-[1,3]dithiane}](/api/spectrum/9UHCfGVLxju/structure.png?h=300&w=458 "(3aR,4aR,8aS)-Octahydro-6H-spiro{cyclopenta[1,4]cyclobuta[1,2]benzene-5,2'-[1,3]dithiane}")
