SpectraBase Spectrum ID |
5GfVgdAXKFH |
Name |
(Z)-tert-Butyl(3-methyl-5-oxo-1-(p-tolyl)-1H-pyrazol-4(5H)-ylidene)carbamate |
Appearance |
Red solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
301.142641481 u |
Formula |
C16H19N3O3 |
InChI |
InChI=1S/C16H19N3O3/c1-10-6-8-12(9-7-10)19-14(20)13(11(2)18-19)17-15(21)22-16(3,4)5/h6-9H,1-5H3/b17-13- |
InChIKey |
RRQJZYRFARJNIB-LGMDPLHJSA-N |
Instrument Name |
Finnigan SSQ 7000 |
Ionization Type |
EI positive ion |
Literature Reference DOI |
10.1002/anie.201709224 |
Molecular Weight |
301.346 g/mol |
Quality |
77 |
SMILES |
C=1(N2N=C(\C(=N\C(=O)OC(C)(C)C)C2=O)C)C=CC(=CC1)C |
SPLASH |
splash10-0a4i-9011000000-f0fe6ff6b05ea8ba1088 |
Source of Spectrum |
ACI-56-SM12-2b (DOI: 10.1002/anie.201709224) |
Thin-Layer Chromatography |
0.36 (n-pentane/EtOAc, 20:1) |
Wiley ID |
1896592 |