SpectraBase Spectrum ID |
AsskcbxzYY7 |
Name |
benzeneethanamine, 3,4-dimethoxy-N-[5-[4-[(4-methylphenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
540.204255934 u |
Formula |
C27H32N4O6S |
InChI |
InChI=1S/C27H32N4O6S/c1-20-4-8-23(9-5-20)38(34,35)30-16-14-29(15-17-30)22-7-10-25(31(32)33)24(19-22)28-13-12-21-6-11-26(36-2)27(18-21)37-3/h4-11,18-19,28H,12-17H2,1-3H3 |
InChIKey |
ZEZLSWYFJMDFKD-UHFFFAOYSA-N |
Molecular Weight |
540.635 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_7070 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10220666; Lab Info: LP; Lab Number: LP-2501140 |