SpectraBase Spectrum ID |
HglRU0etdKP |
Name |
3,5-pyridinedicarboxylic acid, 1,4-dihydro-1-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)ethyl]-4-[4-(trifluoromethoxy)phenyl]-, 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 |
535.218172237 u |
Formula |
C28H32F3NO6 |
InChI |
InChI=1S/C28H32F3NO6/c1-35-25(33)22-15-32(7-8-37-27-12-17-9-18(13-27)11-19(10-17)14-27)16-23(26(34)36-2)24(22)20-3-5-21(6-4-20)38-28(29,30)31/h3-6,15-19,24H,7-14H2,1-2H3 |
InChIKey |
AMDAODOZCJSYGY-UHFFFAOYSA-N |
Molecular Weight |
535.560 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_15417 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/11241299; Lab Info: SAS; Lab Number: SAS-tstz017 |