| SpectraBase Spectrum ID |
2g1QPnZ8CXy |
| Name |
Methyl 4-(3-Oxo-3-((2-oxo-1-phenylcyclohexyl)amino)prop-1-yn-1-yl)benzoate |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
375.147058156 u |
| Formula |
C23H21NO4 |
| InChI |
InChI=1S/C23H21NO4/c1-28-22(27)18-13-10-17(11-14-18)12-15-21(26)24-23(16-6-5-9-20(23)25)19-7-3-2-4-8-19/h2-4,7-8,10-11,13-14H,5-6,9,16H2,1H3,(H,24,26) |
| InChIKey |
RYNGUJIGAYNVCB-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS QP2010SE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.joc.2c02935 |
| Molecular Weight |
375.424 g/mol |
| Quality |
134 |
| Reported Formula |
C23H21NO4 |
| SMILES |
N(C1(C(CCCC1)=O)C1=CC=CC=C1)C(=O)C#CC1=CC=C(C=C1)C(OC)=O |
| SPLASH |
splash10-0006-0902000000-1bd14587b6af6c7b272b |
| Source of Spectrum |
JOC-88-3962-4aj' (DOI: 10.1021/acs.joc.2c02935) |
| Wiley ID |
1912707 |
