SpectraBase Spectrum ID |
BvVzT9ZzDyj |
Name |
ethyl 2-({3-[(2,2,2-trifluoroethoxy)methyl]benzoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
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/C21H22F3NO4S/c1-2-29-20(27)17-15-8-3-4-9-16(15)30-19(17)25-18(26)14-7-5-6-13(10-14)11-28-12-21(22,23)24/h5-7,10H,2-4,8-9,11-12H2,1H3,(H,25,26) |
InChIKey |
VVKIAQNVBPWOMT-UHFFFAOYSA-N |
NMR Offset |
15.449 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI_21270_12450 |
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/9122025; UBI_ID: UBI-012453 |
Temperature |
308 °C |