| SpectraBase Spectrum ID |
15dD8DJsS1U |
| Name |
tert-Butyl 3-(phenylethynyl)-1H-pyrazole-1-carboxylate |
| Appearance |
White crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H16N2O2 |
| InChI |
InChI=1S/C16H16N2O2/c1-16(2,3)20-15(19)18-12-11-14(17-18)10-9-13-7-5-4-6-8-13/h4-8,11-12H,1-3H3 |
| InChIKey |
LQEHVTAJFJBGPR-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu QP2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.p008.842 |
| Molecular Weight |
268.316 g/mol |
| Reported Formula |
C16H16N2O2 |
| SMILES |
C(OC(C)(C)C)(=O)[n]1nc(cc1)C#Cc1ccccc1 |
| SPLASH |
splash10-014i-0900000000-3883eb5c58322b01b8ee |
| Source of Spectrum |
ARK-2014-67-20 |
| Thin-Layer Chromatography |
Rf = 0.4 (ethyl acetate/n-hexane, 1:8) |
| Wiley ID |
1843337 |
