| SpectraBase Spectrum ID |
E4XBoomj0Yx |
| Name |
1.alpha.-Acetoxy-8.beta.-methoxy-10.beta.H-eremophil-7(11)-en-8.alpha.,12-olide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.178023932 u |
| Formula |
C18H26O5 |
| InChI |
InChI=1S/C18H26O5/c1-10-6-7-15(22-12(3)19)14-9-18(21-5)13(8-17(10,14)4)11(2)16(20)23-18/h10,14-15H,6-9H2,1-5H3/t10-,14-,15-,17+,18-/m0/s1 |
| InChIKey |
CWJWCSSMECXYLO-JQGSQVMASA-N |
| Molecular Weight |
322.401 g/mol |
| SMILES |
[C@]12(C(=C(C)C(O2)=O)C[C@]2([C@@](C1)([C@@](OC(=O)C)(CC[C@@]2(C)[H])[H])[H])C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948806 |
