| SpectraBase Spectrum ID |
LEXZT5JZTgY |
| Name |
(Z)-tert-Butyl(3-(tert-butyl)-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)carbamate |
| Appearance |
Red solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
329.173941610 u |
| Formula |
C18H23N3O3 |
| InChI |
InChI=1S/C18H23N3O3/c1-17(2,3)14-13(19-16(23)24-18(4,5)6)15(22)21(20-14)12-10-8-7-9-11-12/h7-11H,1-6H3/b19-13- |
| InChIKey |
MXHMDKIASFIYTK-UYRXBGFRSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/anie.201709224 |
| Molecular Weight |
329.400 g/mol |
| Quality |
84 |
| SMILES |
C=1(N2N=C(\C(=N\C(=O)OC(C)(C)C)C2=O)C(C)(C)C)C=CC=CC1 |
| SPLASH |
splash10-0a4i-9010000000-8e33dde8930930760b14 |
| Source of Spectrum |
ACI-56-SM14-2e (DOI: 10.1002/anie.201709224) |
| Thin-Layer Chromatography |
0.48 (n-pentane/EtOAc, 20:1) |
| Wiley ID |
1896594 |
