SpectraBase Spectrum ID |
Dx9tYj7M99K |
Name |
benzenepropanamine, N-[5-[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-alpha-methyl- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
528.159804300 u |
Formula |
C26H29ClN4O4S |
InChI |
InChI=1S/C26H29ClN4O4S/c1-20(7-8-21-5-3-2-4-6-21)28-25-19-23(11-14-26(25)31(32)33)29-15-17-30(18-16-29)36(34,35)24-12-9-22(27)10-13-24/h2-6,9-14,19-20,28H,7-8,15-18H2,1H3 |
InChIKey |
WGQYOEKOSSUXDG-UHFFFAOYSA-N |
Molecular Weight |
529.055 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_7097 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10220698; Lab Info: LP; Lab Number: LP-2501194 |
Temperature |
29.85 °C |