SpectraBase Spectrum ID |
8ekIlyLWYc4 |
Name |
4-[5-({[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl}sulfanyl)-1H-tetraazol-1-yl]benzoic acid |
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/C14H15N9O2S/c1-22(2)13-17-10(16-12(15)18-13)7-26-14-19-20-21-23(14)9-5-3-8(4-6-9)11(24)25/h3-6H,7H2,1-2H3,(H,24,25)(H2,15,16,17,18) |
InChIKey |
FYDVYZAFKCVYIE-UHFFFAOYSA-N |
NMR Offset |
15.449 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_22121 |
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: D58656; Labnumber: SPLUK-1007; SBI_ID: SBI-022125 |
Temperature |
308 °C |