SpectraBase Spectrum ID |
CllMASJNoPd |
Name |
(3aR)-4,7-dimethyl-2-(4-propoxyphenyl)tetrahydro-1H-4,7-methanoisoindole-1,3,5(2H,4H)-trione |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
341.162708221 u |
Formula |
C20H23NO4 |
InChI |
InChI=1S/C20H23NO4/c1-4-9-25-13-7-5-12(6-8-13)21-17(23)15-16(18(21)24)20(3)11-19(15,2)10-14(20)22/h5-8,15-16H,4,9-11H2,1-3H3/t15-,16-,19+,20+/m0/s1 |
InChIKey |
SZSPPIDCQGEOHT-XAMWDVODSA-N |
Molecular Weight |
341.407 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_15924 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/11250249; Lab Info: MMV; Lab Number: MMV-0104247 |