SpectraBase Spectrum ID |
GVHFJIhmnan |
Name |
3-({[({1-[4-(methoxycarbonyl)phenyl]-1H-tetraazol-5-yl}sulfanyl)acetyl]amino}methyl)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/C19H17N5O5S/c1-29-18(28)13-5-7-15(8-6-13)24-19(21-22-23-24)30-11-16(25)20-10-12-3-2-4-14(9-12)17(26)27/h2-9H,10-11H2,1H3,(H,20,25)(H,26,27) |
InChIKey |
XEMKMVJECJZREN-UHFFFAOYSA-N |
NMR Offset |
15.328 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_22303 |
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: D58576; Labnumber: SPLUK-0858; SBI_ID: SBI-022307 |
Temperature |
318 °C |