| SpectraBase Spectrum ID |
GJHuw97DljM |
| Name |
Methyl 13-.sigma.-acetoxy-14(13-> 16)abeo-labda-8(17),14-dien-19-oate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
376.261359635 u |
| Formula |
C23H36O4 |
| InChI |
InChI=1S/C23H36O4/c1-7-9-18(27-17(3)24)11-12-19-16(2)10-13-20-22(19,4)14-8-15-23(20,5)21(25)26-6/h7,18-20H,1-2,8-15H2,3-6H3/t18?,19-,20?,22+,23-/m0/s1 |
| InChIKey |
UCMURYIXHNXBJU-GRAJITPYSA-N |
| Molecular Weight |
376.537 g/mol |
| SMILES |
[C@@]12(C([C@](C(=O)OC)(C)CCC2)CCC([C@@]1(CCC(OC(=O)C)CC=C)[H])=C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949663 |
