| SpectraBase Spectrum ID |
8FjccUZPG6a |
| Name |
Achillicin |
| CAS Registry Number |
71616-00-7 |
| Classification |
Terpene |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
246.125594437 u |
| Formula |
C15H18O3 |
| InChI |
InChI=1S/C15H18O3/c1-7-4-5-10-9(3)15(17)18-14(10)13-8(2)6-11(16)12(7)13/h6,9-10,13-14H,4-5H2,1-3H3 |
| InChIKey |
BJPSSVHNEGMBDQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
246.306 g/mol |
| Nominal Mass |
246 u |
| Quality |
981 |
| Retention Index |
1851 |
| SMILES |
C12C3C(C(C(O3)=O)C)CCC(=C1C(C=C2C)=O)C |
| SPLASH |
splash10-0002-2940000000-0fcaa0cc6fb23b829a13 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2,3-Epoxy-1,4,10-trihydroxyguai-1(13)en-12,6-olide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_024969 |
![(3S,3aS,9aS,9bS)-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione](/api/spectrum/8FjccUZPG6a/structure.png?h=300&w=458 "(3S,3aS,9aS,9bS)-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione")
