| SpectraBase Spectrum ID |
5kJI3dfgcK4 |
| Name |
benzoic acid, 4-[1-(3-bromo-4-methylphenyl)-3-(4-chlorobenzoyl)-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-2-yl]-, methyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
539.013513411 u |
| Formula |
C26H19BrClNO5 |
| InChI |
InChI=1S/C26H19BrClNO5/c1-14-3-12-19(13-20(14)27)29-22(15-4-6-17(7-5-15)26(33)34-2)21(24(31)25(29)32)23(30)16-8-10-18(28)11-9-16/h3-13,22,31H,1-2H3 |
| InChIKey |
OFPSPPPCWWWDFA-UHFFFAOYSA-N |
| Molecular Weight |
540.797 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_17967 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11240435; Lab Info: GEI; Lab Number: GEI-G008336 |
![benzoic acid, 4-[1-(3-bromo-4-methylphenyl)-3-(4-chlorobenzoyl)-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-2-yl]-, methyl ester](/api/spectrum/5kJI3dfgcK4/structure.png?h=300&w=458 "benzoic acid, 4-[1-(3-bromo-4-methylphenyl)-3-(4-chlorobenzoyl)-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-2-yl]-, methyl ester")
