| SpectraBase Spectrum ID |
9TSxo81TGA3 |
| Name |
benzoic acid, 3,5-dinitro-4-[(2,3,6,7-tetrahydro-1,3,7-trimethyl-2,6-dioxo-1H-purin-8-yl)thio]-, methyl ester |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C16H14N6O8S/c1-18-10-12(19(2)16(25)20(3)13(10)23)17-15(18)31-11-8(21(26)27)5-7(14(24)30-4)6-9(11)22(28)29/h5-6H,1-4H3 |
| InChIKey |
DWLTUCSRPRGDTL-UHFFFAOYSA-N |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Origin |
1H_CB3_9000_4869 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: NMR/12211030; Labnumber: LP-0503458 |
![benzoic acid, 3,5-dinitro-4-[(2,3,6,7-tetrahydro-1,3,7-trimethyl-2,6-dioxo-1H-purin-8-yl)thio]-, methyl ester](/api/spectrum/9TSxo81TGA3/structure.png?h=300&w=458 "benzoic acid, 3,5-dinitro-4-[(2,3,6,7-tetrahydro-1,3,7-trimethyl-2,6-dioxo-1H-purin-8-yl)thio]-, methyl ester")
