SpectraBase Spectrum ID |
CfPhK4vxZbl |
Name |
benzeneacetic acid, 4-[[(benzoylamino)carbonothioyl]amino]-alpha-hydroxy-alpha-(trifluoromethyl)-, methyl 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/C18H15F3N2O4S/c1-27-15(25)17(26,18(19,20)21)12-7-9-13(10-8-12)22-16(28)23-14(24)11-5-3-2-4-6-11/h2-10,26H,1H3,(H2,22,23,24,28) |
InChIKey |
WXEHSRBDWDFISD-UHFFFAOYSA-N |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_CB_8313_1255 |
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/8315345; Labnumber: AU-ec00787 |
Temperature |
303 °C |