| SpectraBase Spectrum ID |
Gr7hfIPKCrA |
| Name |
(1R,2S,5S,6S,7S)-(4E,8Z)-5-(8-Hydroxyoctyl)-4-(pent-2-yn-1-ylidene)-3-oxotricyclo[5.2.1.0(2,6)]dec-8-ene |
| Alternate Name(s) |
(1R,2S,4E,5S,6S,7S)-5-(8-hydroxyoctyl)-4-(2-pentynylidene)tricyclo[5.2.1.0(2,6)]dec-8-en-3-one
(3S,3aS,4S,7R,7aS)-3-(8-Hydroxy-octyl)-2-pent-2-yn-(E)-ylidene-2,3,3a,4,7,7a-hexahydro-4,7-methano-inden-1-one
(4E,8Z)-5-(8-Hydroxyoctyl)-4-(pent-2-yn-1-ylidene)-3-oxotricyclo[5.2.1.0(2,6)]dec-8-ene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H32O2 |
| InChI |
InChI=1S/C23H32O2/c1-2-3-8-12-20-19(11-9-6-4-5-7-10-15-24)21-17-13-14-18(16-17)22(21)23(20)25/h12-14,17-19,21-22,24H,2,4-7,9-11,15-16H2,1H3/b20-12+/t17-,18+,19-,21+,22+/m1/s1 |
| InChIKey |
BBKQDMGAQSKTRC-XVSGDPJYSA-N |
| Molecular Weight |
340.507 g/mol |
| SMILES |
OCCCCCCCC[C@@]1(\C(C([C@@]2([C@]1([C@]1(C[C@@]2(C=C1)[H])[H])[H])[H])=O)=C/C#CCC)[H] |
| SPLASH |
splash10-05di-0491000000-0594fb9ed736d016c4c7 |
| Source of Spectrum |
F-50-12344-10 |
| Wiley ID |
789820 |
![(1R,2S,5S,6S,7S)-(4E,8Z)-5-(8-Hydroxyoctyl)-4-(pent-2-yn-1-ylidene)-3-oxotricyclo[5.2.1.0(2,6)]dec-8-ene](/api/spectrum/Gr7hfIPKCrA/structure.png?h=300&w=458 "(1R,2S,5S,6S,7S)-(4E,8Z)-5-(8-Hydroxyoctyl)-4-(pent-2-yn-1-ylidene)-3-oxotricyclo[5.2.1.0(2,6)]dec-8-ene")
