SpectraBase Spectrum ID |
7BQHXBvHizB |
Name |
3-{[1-(4-chlorobenzyl)-2-methyl-4-nitro-1H-imidazol-5-yl]sulfanyl}propanenitrile |
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/C14H13ClN4O2S/c1-10-17-13(19(20)21)14(22-8-2-7-16)18(10)9-11-3-5-12(15)6-4-11/h3-6H,2,8-9H2,1H3 |
InChIKey |
KBSRRNXILJDDQF-UHFFFAOYSA-N |
NMR Offset |
13.9821 |
NMR Spectrometer Frequency |
250.134 |
Observed nucleus |
1H |
Origin |
1H_ASIOH_7000_4716 |
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: AG-205/7945051; Labnumber: AGG-422; IOH_ID: IOH-004717 |
Temperature |
297 °C |