| SpectraBase Spectrum ID |
C7whNKfJCHJ |
| Name |
15-Acetoxy-11-.beta.,13-dihydroziniolide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.151809184 u |
| Formula |
C17H22O4 |
| InChI |
InChI=1S/C17H22O4/c1-9-6-16-14(10(2)17(19)21-16)7-15-12(4-5-13(9)15)8-20-11(3)18/h4,10,13-16H,1,5-8H2,2-3H3/t10-,13-,14?,15?,16?/m0/s1 |
| InChIKey |
KQDXHSDURJKHAI-SKXAXYCJSA-N |
| SMILES |
C1(OC2CC(=C)[C@]3(C(CC2[C@@]1(C)[H])C(=CC3)COC(=O)C)[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918808 |
