| SpectraBase Spectrum ID |
25ao5xXgHEm |
| Name |
3,4beta-Dihydro-4aalpha,7alpha,7aalpha-nepetalactone |
| 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 |
168.115029753 u |
| Formula |
C10H16O2 |
| InChI |
InChI=1S/C10H16O2/c1-6-3-4-8-7(2)5-12-10(11)9(6)8/h6-9H,3-5H2,1-2H3/t6-,7-,8+,9+/m0/s1 |
| InChIKey |
LSRNBGXEEKNZHN-RBXMUDONSA-N |
| Molecular Weight |
168.236 g/mol |
| Number of Peaks |
15 |
| SMILES |
C1C[C@@]([C@@]2([C@]1([C@](COC2=O)(C)[H])[H])[H])(C)[H] |
| SPLASH |
splash10-03yi-9600000000-f59a69db9385559858ce |
| Source of Spectrum |
FF-3-158-7 (DOI: 10.1002/ffj.2730030404) |
| Synonyms |
(4R,4aR,7S,7aR)-4,7-dimethylhexahydrocyclopenta[c]pyran-1(3H)-one |
| Wiley ID |
1801162 |
