| SpectraBase Spectrum ID |
DiRHEN2RjG9 |
| Name |
rel-(3aS,7aR,E)-2-(Iodo(phenyl)methylene)-3a-methylhexahydro-1H-inden-4(2H)-one |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
366.048060231 u |
| Formula |
C17H19IO |
| InChI |
InChI=1S/C17H19IO/c1-17-11-13(10-14(17)8-5-9-15(17)19)16(18)12-6-3-2-4-7-12/h2-4,6-7,14H,5,8-11H2,1H3/b16-13+/t14-,17+/m1/s1 |
| InChIKey |
QULZJBCFRVXSIG-CRGYSLNVSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jo302751p |
| Molecular Weight |
366.242 g/mol |
| Quality |
130 |
| Reported Formula |
C17H19OI |
| SMILES |
C1C([C@@]2([C@](CC1)(C\C(C2)=C\(I)C1=CC=CC=C1)[H])C)=O |
| SPLASH |
splash10-00ko-2891000000-527eb47f8a2c9b90747e |
| Source of Spectrum |
JOC-78-2783-6k (DOI: 10.1021/jo302751p) |
| Thin-Layer Chromatography |
0.32 (petrolether/Et2O, 8:2) |
| Wiley ID |
1912403 |
