| SpectraBase Spectrum ID |
4MZE1maapf5 |
| Name |
Aristolactone |
| Classification |
Terpene lactones |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
232.146329882 u |
| Formula |
C15H20O2 |
| InChI |
InChI=1S/C15H20O2/c1-10(2)13-8-7-11(3)5-4-6-12-9-14(13)17-15(12)16/h5,9,13-14H,1,4,6-8H2,2-3H3/b11-5+/t13-,14-/m1/s1 |
| InChIKey |
FGWWKPRDQNGBKN-NCWPGJITSA-N |
| Molecular Weight |
232.323 g/mol |
| Number of Peaks |
13 |
| SMILES |
C1CC2=C[C@]([C@](CC\C(=C\1)C)(C(C)=C)[H])(OC2=O)[H] |
| SPLASH |
splash10-052e-9400000000-634a3ca5db295614551c |
| Source of Spectrum |
FF-17-70-70_36 (DOI: 10.1002/ffj.1044) |
| Synonyms |
(8R,9R,E)-5-methyl-8-(prop-1-en-2-yl)-10-oxabicyclo[7.2.1]dodeca-1(12),4-dien-11-one
(1R,2R,5E)-5-methyl-2-(1-methylethenyl)-11-oxabicyclo[7.2.1]dodeca-5,9(12)-dien-10-one
(1R,2R,5E)-5-methyl-2-prop-1-en-2-yl-11-oxabicyclo[7.2.1]dodeca-5,9(12)-dien-10-one |
| Wiley ID |
1775294 |
