SpectraBase Spectrum ID |
7AnUp3sxsVJ |
Name |
(E)-2-(4-Methyldihydrofuran-3(2H)-ylidene)-2-phenylethan-1-ol |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
204.115029753 u |
Formula |
C13H16O2 |
InChI |
InChI=1S/C13H16O2/c1-10-8-15-9-13(10)12(7-14)11-5-3-2-4-6-11/h2-6,10,14H,7-9H2,1H3/b13-12+ |
InChIKey |
MHTGYKKNDLPVAA-OUKQBFOZSA-N |
Instrument Name |
JEOL JMS-700 MStation or JMS-Q1000TD TLC-MS |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/asia.202201241 |
Molecular Weight |
204.269 g/mol |
Optical Rotation |
[a]D32 = +38.1 (c = 1.04, CHCl3) |
Quality |
507 |
Reported Formula |
C13H16O2 |
SMILES |
OC\C(=C/1C(C)COC1)C1=CC=CC=C1 |
SPLASH |
splash10-002f-1900000000-1583eb573bd37ce5b1b0 |
Sample Comments |
96% ee |
Source of Spectrum |
CAJ-18-SM16-4a (DOI: 10.1002/asia.202201241) |
Thin-Layer Chromatography |
0.21 (n-hexane/AcOEt, 3:1) |
Wiley ID |
1901137 |