| SpectraBase Spectrum ID |
C4nGea6NjXH |
| Name |
S-Methyl 4-isopropyl-3,5,11-trioxatetracyclo[5.2.1.1(2,6).0(4,9)]undecane-8-exo-thiocarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18O4S |
| InChI |
InChI=1S/C13H18O4S/c1-5(2)13-9-7-4-6(8(9)10(14)18-3)11(16-13)15-12(7)17-13/h5-9,11-12H,4H2,1-3H3/t6-,7+,8?,9?,11+,12-,13?/m1/s1 |
| InChIKey |
PHRBTAUUYYEUAY-BODHWITISA-N |
| Molecular Weight |
270.343 g/mol |
| SMILES |
C12(O[C@@]3([C@@]4(C2C([C@]([C@](O1)(O3)[H])(C4)[H])C(=O)SC)[H])[H])C(C)C |
| SPLASH |
splash10-00di-0190000000-7a41b7e78fdce1c45031 |
| Source of Spectrum |
QA-43-191-11 |
| Synonyms |
S-methyl 1-isopropyl-8,10,11-trioxatetracyclo[5.3.1.0(2,6).0(4,9)]undecane-3-carbothioate |
| Wiley ID |
862205 |
![S-Methyl 4-isopropyl-3,5,11-trioxatetracyclo[5.2.1.1(2,6).0(4,9)]undecane-8-exo-thiocarboxylate](/api/spectrum/C4nGea6NjXH/structure.png?h=300&w=458 "S-Methyl 4-isopropyl-3,5,11-trioxatetracyclo[5.2.1.1(2,6).0(4,9)]undecane-8-exo-thiocarboxylate")
