| SpectraBase Spectrum ID |
25KN4YNFOOy |
| Name |
13-Bromo-.7,11-ene-beta.cyclocostunolide |
| Alternate Name(s) |
(5aR)-3-(bromomethyl)-5a,9-dimethyl-5,5a,6,7,9a,9b-hexahydronaphtho[1,2-b]furan-2(4H)-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H19BrO2 |
| InChI |
InChI=1S/C15H19BrO2/c1-9-4-3-6-15(2)7-5-10-11(8-16)14(17)18-13(10)12(9)15/h4,12-13H,3,5-8H2,1-2H3/t12?,13?,15-/m1/s1 |
| InChIKey |
AKJRRKOZCBGPDO-SSDMNJCBSA-N |
| Molecular Weight |
311.219 g/mol |
| SMILES |
C1(=C2C(C3C(=CCC[C@@]3(CC2)C)C)OC1=O)CBr |
| SPLASH |
splash10-001i-0091000000-3434ab55feef3ad6f8f5 |
| Source of Spectrum |
J-56-3590-16 |
| Wiley ID |
1311277 |
