4-(5-amino-1,3,4-thiadiazol-2-yl)-2,2-bis[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-1-phenyl-1-butanone

SpectraBase Compound ID	LC0xk75oMii
InChI	InChI=1S/C20H23N9OS3/c21-17-27-24-13(31-17)6-9-20(10-7-14-25-28-18(22)32-14,11-8-15-26-29-19(23)33-15)16(30)12-4-2-1-3-5-12/h1-5H,6-11H2,(H2,21,27)(H2,22,28)(H2,23,29)
InChIKey	JJDAFQRUQCFQBE-UHFFFAOYSA-N Google Search
Mol Weight	501.65 g/mol
Molecular Formula	C20H23N9OS3
Exact Mass	501.11877 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	D00c8ZFMy4m
Name	4-(5-amino-1,3,4-thiadiazol-2-yl)-2,2-bis[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-1-phenyl-1-butanone
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/C20H23N9OS3/c21-17-27-24-13(31-17)6-9-20(10-7-14-25-28-18(22)32-14,11-8-15-26-29-19(23)33-15)16(30)12-4-2-1-3-5-12/h1-5H,6-11H2,(H2,21,27)(H2,22,28)(H2,23,29)
InChIKey	JJDAFQRUQCFQBE-UHFFFAOYSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_ASIOH_7529_1446
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/9258604; Labnumber: BAS1048642
Temperature	303 °C