SpectraBase Spectrum ID |
AcrLEqBfgP1 |
Name |
benzeneacetonitrile, 4-bromo-alpha-[[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
410.018539223 u |
Formula |
C21H16BrClN2 |
InChI |
InChI=1S/C21H16BrClN2/c1-14-11-17(12-18(13-24)16-3-5-19(22)6-4-16)15(2)25(14)21-9-7-20(23)8-10-21/h3-12H,1-2H3/b18-12- |
InChIKey |
DWNJJKVSKCKJAB-PDGQHHTCSA-N |
Molecular Weight |
411.730 g/mol |
NMR Offset |
15.0036 |
NMR Spectrometer Frequency |
250.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_156 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/7112313; Lab Info: LD; Lab Number: LD-1390670 |
Temperature |
23.85 °C |