| SpectraBase Spectrum ID |
JIHhePuXATO |
| Name |
benzoic acid, 4-[[4-[4-methyl-3-[[(2-pyridinylmethyl)amino]sulfonyl]phenyl]-1-phthalazinyl]amino]-, 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 |
539.162725475 u |
| Formula |
C29H25N5O4S |
| InChI |
InChI=1S/C29H25N5O4S/c1-19-10-11-21(17-26(19)39(36,37)31-18-23-7-5-6-16-30-23)27-24-8-3-4-9-25(24)28(34-33-27)32-22-14-12-20(13-15-22)29(35)38-2/h3-17,31H,18H2,1-2H3,(H,32,34) |
| InChIKey |
BYBBEKWZUIYLRV-UHFFFAOYSA-N |
| Molecular Weight |
539.610 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_14803 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10310121; Lab Info: ZUB; Lab Number: ZUB-0000836 |
![benzoic acid, 4-[[4-[4-methyl-3-[[(2-pyridinylmethyl)amino]sulfonyl]phenyl]-1-phthalazinyl]amino]-, methyl ester](/api/spectrum/JIHhePuXATO/structure.png?h=300&w=458 "benzoic acid, 4-[[4-[4-methyl-3-[[(2-pyridinylmethyl)amino]sulfonyl]phenyl]-1-phthalazinyl]amino]-, methyl ester")
