SpectraBase Spectrum ID |
FbAVliFfBD6 |
Name |
5-{[3-(aminocarbonyl)-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}-5-oxopentanoic acid |
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/C16H22N2O4S/c1-2-9-6-7-10-11(8-9)23-16(14(10)15(17)22)18-12(19)4-3-5-13(20)21/h9H,2-8H2,1H3,(H2,17,22)(H,18,19)(H,20,21) |
InChIKey |
YPYUXYGSMYLXGI-UHFFFAOYSA-N |
NMR Offset |
15.328 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI_21270_20380 |
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/9163437; UBI_ID: UBI-020384 |
Temperature |
318 °C |