| SpectraBase Spectrum ID |
ctYiQLDp3 |
| Name |
3,5-pyridinedicarboxylic acid, 1,4-dihydro-4-(2-thienyl)-1-(2-tricyclo[3.3.1.1~3,7~]dec-1-ylethyl)-, 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 |
441.197379652 u |
| Formula |
C25H31NO4S |
| InChI |
InChI=1S/C25H31NO4S/c1-29-23(27)19-14-26(15-20(24(28)30-2)22(19)21-4-3-7-31-21)6-5-25-11-16-8-17(12-25)10-18(9-16)13-25/h3-4,7,14-18,22H,5-6,8-13H2,1-2H3/t16-,17+,18-,25+ |
| InChIKey |
XPKVKOBVKVIXCU-UVULGIRGSA-N |
| Molecular Weight |
441.586 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_15409 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11241290; Lab Info: SAS; Lab Number: SAS-tstz008 |
![3,5-pyridinedicarboxylic acid, 1,4-dihydro-4-(2-thienyl)-1-(2-tricyclo[3.3.1.1~3,7~]dec-1-ylethyl)-, dimethyl ester](/api/spectrum/ctYiQLDp3/structure.png?h=300&w=458 "3,5-pyridinedicarboxylic acid, 1,4-dihydro-4-(2-thienyl)-1-(2-tricyclo[3.3.1.1~3,7~]dec-1-ylethyl)-, dimethyl ester")
