| SpectraBase Spectrum ID |
A3EcfeJCqiY |
| Name |
(1R,8as)-1-(2-Ketoethyl)-5,5,8A-trimethyl-1,4,4A,6,7,8-hexahydronaphthalene-2-carbaldehyde |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.177630011 u |
| Formula |
C16H24O2 |
| InChI |
InChI=1S/C16H24O2/c1-15(2)8-4-9-16(3)13(7-10-17)12(11-18)5-6-14(15)16/h5,10-11,13-14H,4,6-9H2,1-3H3/t13-,14?,16+/m0/s1 |
| InChIKey |
KHOLGGKSBXYXKF-XWDNMSNZSA-N |
| Molecular Weight |
248.366 g/mol |
| SMILES |
[C@]12(C(CC=C([C@@]2(CC=O)[H])C=O)C(C)(C)CCC1)C |
