SpectraBase Spectrum ID |
dgKmMqRo3H |
Name |
benzeneethanamine, N-[2-nitro-5-[4-(4-phenyl-5-propyl-2-thiazolyl)-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 |
527.235496495 u |
Formula |
C30H33N5O2S |
InChI |
InChI=1S/C30H33N5O2S/c1-2-9-28-29(24-12-7-4-8-13-24)32-30(38-28)34-20-18-33(19-21-34)25-14-15-27(35(36)37)26(22-25)31-17-16-23-10-5-3-6-11-23/h3-8,10-15,22,31H,2,9,16-21H2,1H3 |
InChIKey |
NJQHPUVHOJJNGB-UHFFFAOYSA-N |
Molecular Weight |
527.687 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_9690 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10240911; Lab Info: LP; Lab Number: LP-2100526 |
Temperature |
23.85 °C |