SpectraBase Spectrum ID |
LUjGdW6Oq9G |
Name |
Labda-8(20),13-diene-15,19-dioic acid, methyl ester, tms |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
420.269586299 u |
Formula |
C24H40O4Si |
InChI |
InChI=1S/C24H40O4Si/c1-17(16-21(25)27-5)10-12-19-18(2)11-13-20-23(19,3)14-9-15-24(20,4)22(26)28-29(6,7)8/h16,19-20H,2,9-15H2,1,3-8H3/b17-16+/t19-,20+,23+,24-/m0/s1 |
InChIKey |
LKQPHKJUXIYWLB-WTKKMZFQSA-N |
Molecular Weight |
420.665 g/mol |
SMILES |
C1CC[C@](C)(C(=O)O[Si](C)(C)C)[C@]2([C@@]1(C)[C@](C(CC2)=C)(CC\C(C)=C\C(=O)OC)[H])[H] |