SpectraBase Spectrum ID |
67kvkHD3tl9 |
Name |
5H-cyclopenta[b]pyridine-3-carbonitrile, 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-4-(3-cyclohexen-1-yl)-6,7-dihydro- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
408.106312177 u |
Formula |
C23H21ClN2OS |
InChI |
InChI=1S/C23H21ClN2OS/c24-17-11-9-15(10-12-17)21(27)14-28-23-19(13-25)22(16-5-2-1-3-6-16)18-7-4-8-20(18)26-23/h1-2,9-12,16H,3-8,14H2 |
InChIKey |
DVKJGVXAUTXLCI-UHFFFAOYSA-N |
Molecular Weight |
408.947 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_9228 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9301766; Lab Info: DVD; Lab Number: DVD-0000086 |