SpectraBase Spectrum ID |
5gJDO2FT2iv |
Name |
methyl 2-{[(3-chloroanilino)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-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/C18H19ClN2O3S/c1-24-17(22)15-13-8-3-2-4-9-14(13)25-16(15)21-18(23)20-12-7-5-6-11(19)10-12/h5-7,10H,2-4,8-9H2,1H3,(H2,20,21,23) |
InChIKey |
IDICQQZGCDLESU-UHFFFAOYSA-N |
NMR Offset |
15.328 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI_21270_19776 |
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/9150083; UBI_ID: UBI-019780 |
Temperature |
318 °C |