SpectraBase Spectrum ID |
LalZELAE8Hx |
Name |
(Z)-2-(Cyclohexyl(hydroxy)methyl)-3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acrylonitrile |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H21NO3 |
InChI |
InChI=1S/C18H21NO3/c19-12-15(18(20)14-4-2-1-3-5-14)10-13-6-7-16-17(11-13)22-9-8-21-16/h6-7,10-11,14,18,20H,1-5,8-9H2/b15-10- |
InChIKey |
URWPGJKACNZLAH-GDNBJRDFSA-N |
Instrument Name |
Finnigan MAT95Q/Finnigan MAT90 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.202012085 |
Molecular Weight |
299.370 g/mol |
Reported Formula |
C18H21O3N |
SMILES |
OC(C1CCCCC1)\C(=C/c1ccc2c(OCCO2)c1)C#N |
SPLASH |
splash10-014i-1290000000-995bc94aa5a64c09d634 |
Sample Comments |
Z/E = 99:1 |
Source of Spectrum |
ACI-60-SM22-7cl |
Wiley ID |
1880409 |