SpectraBase Spectrum ID |
BkxbfIgqPL |
Name |
2-(5-{[1,4'-bipiperidin]-1'-yl}-5-oxopentyl)-6-methoxy-3-sulfanylidene-1H,2H,3H,4H,9H-indeno[2,1-c]pyridin-1-one |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
497.246061178 u |
Formula |
C26H35N5O3S |
InChI |
InChI=1S/C26H35N5O3S/c1-34-19-8-9-21-20(17-19)23-24(27-21)25(33)31(26(35)28-23)14-6-3-7-22(32)30-15-10-18(11-16-30)29-12-4-2-5-13-29/h8-9,17-18,27H,2-7,10-16H2,1H3,(H,28,35) |
InChIKey |
JCBKXEWYUGETDV-UHFFFAOYSA-N |
Molecular Weight |
497.658 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_6457 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13289668 |