| SpectraBase Spectrum ID |
5O9wTvicswN |
| Name |
benzoic acid, 4-(6-nitro-4-oxo-2-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-3(4H)-quinazolinyl)-, ethyl 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 |
515.191716928 u |
| Formula |
C26H25N7O5 |
| InChI |
InChI=1S/C26H25N7O5/c1-2-38-25(35)18-4-6-19(7-5-18)32-23(29-22-9-8-20(33(36)37)16-21(22)24(32)34)17-30-12-14-31(15-13-30)26-27-10-3-11-28-26/h3-11,16H,2,12-15,17H2,1H3 |
| InChIKey |
RPZCDDBHKCAYBF-UHFFFAOYSA-N |
| Molecular Weight |
515.530 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_4732 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13288438 |
![benzoic acid, 4-(6-nitro-4-oxo-2-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-3(4H)-quinazolinyl)-, ethyl ester](/api/spectrum/5O9wTvicswN/structure.png?h=300&w=458 "benzoic acid, 4-(6-nitro-4-oxo-2-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-3(4H)-quinazolinyl)-, ethyl ester")
