| SpectraBase Spectrum ID |
KcthbQ6umKv |
| Name |
4-{[4-chloro-3-(hexahydro-1H-azepin-1-ylsulfonyl)benzoyl]amino}benzoic 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/C20H21ClN2O5S/c21-17-10-7-15(19(24)22-16-8-5-14(6-9-16)20(25)26)13-18(17)29(27,28)23-11-3-1-2-4-12-23/h5-10,13H,1-4,11-12H2,(H,22,24)(H,25,26) |
| InChIKey |
NNZWJMTXZLOBAE-UHFFFAOYSA-N |
| NMR Offset |
15.0036 |
| NMR Spectrometer Frequency |
250.134 |
| Observed nucleus |
1H |
| Origin |
1H_ASIOH_7000_3730 |
| 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: ZI/7086162; Labnumber: SP-0001726; IOH_ID: IOH-003731 |
| Temperature |
297 °C |
![4-{[4-chloro-3-(hexahydro-1H-azepin-1-ylsulfonyl)benzoyl]amino}benzoic acid](/api/spectrum/KcthbQ6umKv/structure.png?h=300&w=458 "4-{[4-chloro-3-(hexahydro-1H-azepin-1-ylsulfonyl)benzoyl]amino}benzoic acid")
