| SpectraBase Spectrum ID |
GdSA48ObrQx |
| Name |
1,4-Diethylhexyl 4-cyanobenzoate |
| Alternate Name(s) |
4-Cyanobenzoic acid, 6-ethyl-3-octyl ester
4-cyanobenzoic acid 6-ethyloctan-3-yl ester
6-Ethyloctan-3-yl 4-cyanobenzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H25NO2 |
| InChI |
InChI=1S/C18H25NO2/c1-4-14(5-2)9-12-17(6-3)21-18(20)16-10-7-15(13-19)8-11-16/h7-8,10-11,14,17H,4-6,9,12H2,1-3H3 |
| InChIKey |
NDCLLWVYNRGJFI-UHFFFAOYSA-N |
| Molecular Weight |
287.403 g/mol |
| SMILES |
C(OC(c1ccc(cc1)C#N)=O)(CCC(CC)CC)CC |
| SPLASH |
splash10-001i-9400000000-16649943f626f4f69ecf |
| Source of Spectrum |
NP-9-3568-0 |
| Wiley ID |
1108057 |
