SpectraBase Spectrum ID |
6b3tBrf5FfU |
Name |
(E)-3-Chloro-5-(2,4,7-trimethyl-1-oxooct-2,6-dien-4-yl)benzonitrile |
Appearance |
Yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H20ClNO |
InChI |
InChI=1S/C18H20ClNO/c1-13(2)5-6-18(4,10-14(3)12-21)16-7-15(11-20)8-17(19)9-16/h5,7-10,12H,6H2,1-4H3/b14-10+ |
InChIKey |
MHQSCYZSJUUNBM-GXDHUFHOSA-N |
Instrument Name |
GCMS |
Ionization Type |
EI |
Molecular Weight |
301.817 g/mol |
SMILES |
c1(cc(cc(c1)Cl)C(\C=C\(C=O)C)(CC=C(C)C)C)C#N |
SPLASH |
splash10-014i-9240000000-fa02f50a8f1f53ff2022 |
Source of Spectrum |
CN114761385A |
Wiley ID |
1884533 |