SpectraBase Spectrum ID |
8FH13OqOTiK |
Name |
1-(((2S,4R,E)-6-Iodo-4-methylhept-5-en-2-yl)oxy)-4-methoxybenzene |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H21IO2 |
InChI |
InChI=1S/C15H21IO2/c1-11(9-12(2)16)10-13(3)18-15-7-5-14(17-4)6-8-15/h5-9,11,13H,10H2,1-4H3/b12-9+/t11-,13-/m0/s1 |
InChIKey |
GFXBHVDLUXESFW-XLCKQVHISA-N |
Instrument Name |
Finnigan MAT 95 XL |
Ionization Type |
EI |
Literature Reference DOI |
10.3762/bjoc.15.53 |
Molecular Weight |
360.235 g/mol |
Optical Rotation |
[a]D29 = -4.5 (c = 1.30, CHCl3) |
Reported Formula |
C15H21O2I |
SMILES |
c1(ccc(cc1)OC)O[C@](C[C@](\C=C/(I)C)(C)[H])(C)[H] |
SPLASH |
splash10-00di-1901000000-fe16e5f18b3aff535fe9 |
Source of Spectrum |
BJO-15-SM13-18 |
Thin-Layer Chromatography |
Rf = 0.58 |
Wiley ID |
1841008 |