SpectraBase Spectrum ID |
H6wofbYkvHD |
Name |
benzenemethanamine, 4-chloro-N-[2-nitro-5-[4-[(phenylmethyl)sulfonyl]-1-piperazinyl]phenyl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
500.128504171 u |
Formula |
C24H25ClN4O4S |
InChI |
InChI=1S/C24H25ClN4O4S/c25-21-8-6-19(7-9-21)17-26-23-16-22(10-11-24(23)29(30)31)27-12-14-28(15-13-27)34(32,33)18-20-4-2-1-3-5-20/h1-11,16,26H,12-15,17-18H2 |
InChIKey |
ROSGHXWCZTWGPS-UHFFFAOYSA-N |
Molecular Weight |
501.001 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_11049 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10251277; Lab Info: LP; Lab Number: LP-2501345 |
Temperature |
29.85 °C |