| SpectraBase Spectrum ID |
7IQLTWUXzZQ |
| Name |
3,5-pyridinedicarboxylic acid, 4-(1,3-benzodioxol-5-yl)-1-(1,3-benzodioxol-5-ylmethyl)-1,4-dihydro-, dimethyl 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 |
451.126716632 u |
| Formula |
C24H21NO8 |
| InChI |
InChI=1S/C24H21NO8/c1-28-23(26)16-10-25(9-14-3-5-18-20(7-14)32-12-30-18)11-17(24(27)29-2)22(16)15-4-6-19-21(8-15)33-13-31-19/h3-8,10-11,22H,9,12-13H2,1-2H3 |
| InChIKey |
PUPCYTIHHHCLIN-UHFFFAOYSA-N |
| Molecular Weight |
451.431 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11346 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10261333; Lab Info: SAS; Lab Number: SAS-tst3910 |
| Temperature |
29.85 °C |
