SpectraBase Spectrum ID |
2UQyDPXP0qc |
Name |
benzoic acid, 2-[[(4-methyl-2-benzothiazolyl)amino]carbonyl]-3-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 |
357.041941635 u |
Formula |
C16H11N3O5S |
InChI |
InChI=1S/C16H11N3O5S/c1-8-4-2-7-11-13(8)17-16(25-11)18-14(20)12-9(15(21)22)5-3-6-10(12)19(23)24/h2-7H,1H3,(H,21,22)(H,17,18,20) |
InChIKey |
YTJYQLAQTUUDFR-UHFFFAOYSA-N |
Molecular Weight |
357.340 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_2680 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/9020384; Lab Info: DK; Lab Number: DK-1200115 |