SpectraBase Spectrum ID |
6Ab59f4uB9T |
Name |
1H-pyrrole-1-butanoic acid, 3-benzoyl-2-(4-bromophenyl)-2,5-dihydro-4-hydroxy-5-oxo- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
443.036835679 u |
Formula |
C21H18BrNO5 |
InChI |
InChI=1S/C21H18BrNO5/c22-15-10-8-13(9-11-15)18-17(19(26)14-5-2-1-3-6-14)20(27)21(28)23(18)12-4-7-16(24)25/h1-3,5-6,8-11,18,27H,4,7,12H2,(H,24,25) |
InChIKey |
NPLLOFTXHKTLAN-UHFFFAOYSA-N |
Molecular Weight |
444.281 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_9955 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9236425; Lab Info: GEI; Lab Number: GEI-G003610 |