SpectraBase Spectrum ID |
IWPASTzKod9 |
Name |
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-3-methyl-4-nitrobenzamide |
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/C21H23N3O3S/c1-12-9-13(5-8-17(12)24(26)27)19(25)23-20-16(11-22)15-7-6-14(21(2,3)4)10-18(15)28-20/h5,8-9,14H,6-7,10H2,1-4H3,(H,23,25) |
InChIKey |
PPHOKNFBVMAQMG-UHFFFAOYSA-N |
NMR Offset |
14.9921 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI_21270_2597 |
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: UZI/8061497; UBI_ID: UBI-002598 |
Temperature |
313 °C |