SpectraBase Spectrum ID |
5BCIcRVtxO4 |
Name |
butanoic acid, 4-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridinyl]thio]-3-oxo-, ethyl ester |
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/C17H13F3N2O3S2/c1-2-25-15(24)6-10(23)9-27-16-11(8-21)12(17(18,19)20)7-13(22-16)14-4-3-5-26-14/h3-5,7H,2,6,9H2,1H3 |
InChIKey |
OUWIEMQPMBFADD-UHFFFAOYSA-N |
NMR Offset |
16.0087 |
NMR Spectrometer Frequency |
500.133 |
Observed nucleus |
1H |
Origin |
1H_ASIOH_8516_657 |
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: 63TSH0.084; IOH_ID: IOH-007658 |