| SpectraBase Spectrum ID |
5d8CD0LfhOk |
| Name |
1-Methyl-8-methylthio-9,11,13,14-tetraoxapentacyclo[6.5.1.0(2,7).0(3,12).0(6,10)]tetradecane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16O4S |
| InChI |
InChI=1S/C12H16O4S/c1-11-7-5-3-4-6-8(7)12(16-11,17-2)15-10(6)13-9(5)14-11/h5-10H,3-4H2,1-2H3/t5-,6+,7-,8+,9+,10-,11+,12+/m0/s1 |
| InChIKey |
DZHFJBACVVLPBG-MTJBBZHSSA-N |
| Molecular Weight |
256.316 g/mol |
| SMILES |
[C@]12(O[C@]3(O[C@@]4([C@@]5([C@]3([C@]2([C@@](CC5)([C@](O1)(O4)[H])[H])[H])[H])[H])[H])C)SC |
| SPLASH |
splash10-0a4i-0090000000-586d972baf78c3f4548d |
| Source of Spectrum |
QA-43-185-17 |
| Synonyms |
1-methyl-12-(methylsulfanyl)-9,11,13,14-tetraoxapentacyclo[6.5.1.0(2,7).0(3,12).0(4,10)]tetradecane
methyl 12-methyl-9,11,13,14-tetraoxapentacyclo[6.5.1.0(2,7).0(3,12).0(4,10)]tetradec-1-yl sulfide |
| Wiley ID |
862216 |
![1-Methyl-8-methylthio-9,11,13,14-tetraoxapentacyclo[6.5.1.0(2,7).0(3,12).0(6,10)]tetradecane](/api/spectrum/5d8CD0LfhOk/structure.png?h=300&w=458 "1-Methyl-8-methylthio-9,11,13,14-tetraoxapentacyclo[6.5.1.0(2,7).0(3,12).0(6,10)]tetradecane")
