SpectraBase Spectrum ID |
HN9qSld3PLN |
Name |
(4aS,9bR)-8-Iodo-2,2,4,4-tetramethyl-4a,9b-dihydro-4H-[1,3]dioxino[5,4-b]benzofuran-7-ol |
Appearance |
Yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H17IO4 |
InChI |
InChI=1S/C14H17IO4/c1-13(2)12-11(18-14(3,4)19-13)7-5-8(15)9(16)6-10(7)17-12/h5-6,11-12,16H,1-4H3/t11-,12+/m1/s1 |
InChIKey |
LHXOBEVZEJKOPV-NEPJUHHUSA-N |
Instrument Name |
Finnigan SSQ7000 |
Ionization Type |
EI |
Literature Reference DOI |
10.3762/bjoc.8.123 |
Molecular Weight |
376.190 g/mol |
Optical Rotation |
[a]D23 = 57.7 (c = 1.7, CHCl3) |
SMILES |
Oc1c(cc2c(c1)O[C@]1([C@@]2(OC(OC1(C)C)(C)C)[H])[H])I |
SPLASH |
splash10-03di-1196000000-5db94bff198dc2424313 |
Source of Spectrum |
BJO-8-SM9-17 |
Thin-Layer Chromatography |
Rf = 0.42 (pentane/diethylether, 1:1) |
Wiley ID |
1864889 |