SpectraBase Spectrum ID |
FbEnpOZWLB8 |
Name |
1H-isoindole-1,3(2H)-dione, 2-[2-[[(2-methoxy-5-nitrophenyl)methyl]thio]-6-benzothiazolyl]-5-nitro- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
522.030391148 u |
Formula |
C23H14N4O7S2 |
InChI |
InChI=1S/C23H14N4O7S2/c1-34-19-7-4-14(26(30)31)8-12(19)11-35-23-24-18-6-3-13(10-20(18)36-23)25-21(28)16-5-2-15(27(32)33)9-17(16)22(25)29/h2-10H,11H2,1H3 |
InChIKey |
IZEXTWDAUUGWPM-UHFFFAOYSA-N |
Molecular Weight |
522.506 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_9914 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9244585; Lab Info: LP; Lab Number: LP-0609088 |