SpectraBase Spectrum ID |
KI92D8C4tLQ |
Name |
butanoic acid, 4-(methylthio)-2-[[[4-(1-naphthalenylmethyl)-1-piperazinyl]carbonothioyl]amino]-, methyl ester, (2S)- |
Author |
A.V.Yarkov, IPAC, Russia |
Copyright |
Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved. |
InChI |
InChI=1S/C22H29N3O2S2/c1-27-21(26)20(10-15-29-2)23-22(28)25-13-11-24(12-14-25)16-18-8-5-7-17-6-3-4-9-19(17)18/h3-9,20H,10-16H2,1-2H3,(H,23,28) |
InChIKey |
JXGBOUXFAHXKSB-UHFFFAOYSA-N |
NMR Offset |
15.5012 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_11628_11109 |
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: F41044; Labnumber: NNA-V-23973 |
Temperature |
315 °C |