SpectraBase Spectrum ID |
HSWWdXGtmqD |
Name |
2-{5-[4-(ethylsulfonyl)-1-piperazinyl]-2-nitrophenyl}-4-methyl-1(2H)-phthalazinone |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
457.141990030 u |
Formula |
C21H23N5O5S |
InChI |
InChI=1S/C21H23N5O5S/c1-3-32(30,31)24-12-10-23(11-13-24)16-8-9-19(26(28)29)20(14-16)25-21(27)18-7-5-4-6-17(18)15(2)22-25/h4-9,14H,3,10-13H2,1-2H3 |
InChIKey |
FBCFKOBBOJCNDP-UHFFFAOYSA-N |
Molecular Weight |
457.505 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_4045 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12308674 |