SpectraBase Spectrum ID |
BjMIqTGXUJt |
Name |
[3-Acetoxy-3-(4'-acetoxybutyl)-2-chlorocyclohexylidene]acetonitrile |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H22ClNO4 |
InChI |
InChI=1S/C16H22ClNO4/c1-12(19)21-11-4-3-8-16(22-13(2)20)9-5-6-14(7-10-18)15(16)17/h7,15H,3-6,8-9,11H2,1-2H3/b14-7+ |
InChIKey |
RJOUZDHLOLGWMQ-VGOFMYFVSA-N |
Molecular Weight |
327.808 g/mol |
SMILES |
C1(C(\C(=C\C#N)CCC1)Cl)(OC(=O)C)CCCCOC(=O)C |
SPLASH |
splash10-03fr-0962000000-1186ce64d4d1429ecf08 |
Source of Spectrum |
U-1995-26-0 |
Synonyms |
(3E)-1-[4-(acetyloxy)butyl]-2-chloro-3-(cyanomethylene)cyclohexyl acetate |
Wiley ID |
766420 |