SpectraBase Spectrum ID |
4ca0ykH1nAV |
Name |
8-azabicyclo[3.2.1]oct-2-ene-6-carboxylic acid, 8-[(3-methoxyphenyl)methyl]-4-oxo-, 1,1-dimethylethyl 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 |
343.178358285 u |
Formula |
C20H25NO4 |
InChI |
InChI=1S/C20H25NO4/c1-20(2,3)25-19(23)16-11-14-8-9-17(22)18(16)21(14)12-13-6-5-7-15(10-13)24-4/h5-10,14,16,18H,11-12H2,1-4H3/t14-,16?,18-/m1/s1 |
InChIKey |
XHKRZZKPVOIIPD-OXPKRCOGSA-N |
Molecular Weight |
343.423 g/mol |
NMR Offset |
18.5777 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_9010 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/14211942; Lab Info: KIC; Lab Number: KIC-0000007 |