| SpectraBase Spectrum ID |
B12WZnt56bA |
| Name |
1-Hexyn-1-ol, 4-nitrobenzoate |
| Alternate Name(s) |
1-Hexynyl 4-nitrobenzoate
1-Hexynyl p-nitrobenzoate |
| CAS Registry Number |
113779-42-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13NO4 |
| InChI |
InChI=1S/C13H13NO4/c1-2-3-4-5-10-18-13(15)11-6-8-12(9-7-11)14(16)17/h6-9H,2-4H2,1H3 |
| InChIKey |
NRNOAFLUUSJIIR-UHFFFAOYSA-N |
| Molecular Weight |
247.250 g/mol |
| SMILES |
c1(N(=O)=O)ccc(C(=O)OC#CCCCC)cc1 |
| SPLASH |
splash10-0udi-2900000000-de409de58ecd832f6d0a |
| Source of Spectrum |
C-110-3274-6 |
| Wiley ID |
1249931 |
