| SpectraBase Spectrum ID |
4ProKlWfgMk |
| Name |
3,7-Dimethyloct-6-en-1-yn-3-yl 4'-nitrobenzoate |
| Alternate Name(s) |
1-Ethynyl-1,5-dimethyl-4-hexenyl 4-nitrobenzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19NO4 |
| InChI |
InChI=1S/C17H19NO4/c1-5-17(4,12-6-7-13(2)3)22-16(19)14-8-10-15(11-9-14)18(20)21/h1,7-11H,6,12H2,2-4H3 |
| InChIKey |
DAPYWDAAEAKIJI-UHFFFAOYSA-N |
| Molecular Weight |
301.342 g/mol |
| SMILES |
c1(N(=O)=O)ccc(C(OC(C#C)(CCC=C(C)C)C)=O)cc1 |
| SPLASH |
splash10-0gbc-4900000000-3e7a5dd9e9d4ae94adae |
| Source of Spectrum |
KC-61-4798-5 |
| Wiley ID |
1629151 |
