SpectraBase Spectrum ID |
LdhZLjmyijp |
Name |
(3E,5E)-1-methyl-3,5-bis[4-(methylsulfanyl)benzylidene]-4-piperidinone |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
381.122106712 u |
Formula |
C22H23NOS2 |
InChI |
InChI=1S/C22H23NOS2/c1-23-14-18(12-16-4-8-20(25-2)9-5-16)22(24)19(15-23)13-17-6-10-21(26-3)11-7-17/h4-13H,14-15H2,1-3H3/b18-12+,19-13+ |
InChIKey |
MZWLWOCKZOXMAV-KLCVKJMQSA-N |
Molecular Weight |
381.552 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_3957 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12308557 |