SpectraBase Spectrum ID |
BeSHlIPnkB8 |
Name |
(5S-Acetoxy-3R-tigloxy-7-hydroxy)-(p-menth-6-en-2-one, (S)), tms derivative |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
396.196815279 u |
Formula |
C20H32O6Si |
InChI |
InChI=1S/C20H32O6Si/c1-9-13(4)20(23)26-19-17(12(2)3)16(25-14(5)21)10-15(18(19)22)11-24-27(6,7)8/h9-10,12,16-17,19H,11H2,1-8H3/b13-9+/t16-,17-,19+/m0/s1 |
InChIKey |
ZRUGUCACDVRRPN-HCWMHUGKSA-N |
Molecular Weight |
396.555 g/mol |
SMILES |
C[Si](C)(C)OCC=1C(=O)[C@](OC(\C(=C\C)C)=O)([C@@](C(C)C)([C@@](OC(C)=O)(C1)[H])[H])[H] |