| SpectraBase Spectrum ID |
9vSkgJBIgds |
| Name |
16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid, tms derivative |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
448.264500918 u |
| Formula |
C25H40O5Si |
| InChI |
InChI=1S/C25H40O5Si/c1-17-14-21(27)23-24(3,4)12-9-13-25(23,5)20(17)11-10-19(16-29-18(2)26)15-22(28)30-31(6,7)8/h14-15,20,23H,9-13,16H2,1-8H3/b19-15+/t20-,23-,25+/m0/s1 |
| InChIKey |
USEKPMXXFOAMGB-FDAUDBFFSA-N |
| Molecular Weight |
448.675 g/mol |
| SMILES |
C1CCC(C)(C)[C@]2([C@@]1(C)[C@](C(=CC2=O)C)(CC\C(COC(=O)C)=C/C(=O)O[Si](C)(C)C)[H])[H] |
