ethanone, 1-[4-(2,2-dichlorocyclopropyl)phenyl]-2-(9H-purin-6-ylthio)-

SpectraBase Compound ID	FVsEKZj7Qjo
InChI	InChI=1S/C16H12Cl2N4OS/c17-16(18)5-11(16)9-1-3-10(4-2-9)12(23)6-24-15-13-14(20-7-19-13)21-8-22-15/h1-4,7-8,11H,5-6H2,(H,19,20,21,22)
InChIKey	KJHJENFOBFRUJW-UHFFFAOYSA-N Google Search
Mol Weight	379.27 g/mol
Molecular Formula	C16H12Cl2N4OS
Exact Mass	378.010888 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	G8STR0KiEmB
Name	ethanone, 1-[4-(2,2-dichlorocyclopropyl)phenyl]-2-(9H-purin-6-ylthio)-
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/C16H12Cl2N4OS/c17-16(18)5-11(16)9-1-3-10(4-2-9)12(23)6-24-15-13-14(20-7-19-13)21-8-22-15/h1-4,7-8,11H,5-6H2,(H,19,20,21,22)
InChIKey	KJHJENFOBFRUJW-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_10237
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: F36845; Labnumber: YAKV-44555
Temperature	315 °C