| SpectraBase Spectrum ID |
Bg3iSe8425i |
| Name |
2-butenoic acid, 4-[[2-[(hexahydro-1H-azepin-1-yl)sulfonyl]ethyl][(1-methyl-1H-pyrazol-4-yl)methyl]amino]-4-oxo-, (2E)- |
| 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/C17H26N4O5S/c1-19-13-15(12-18-19)14-20(16(22)6-7-17(23)24)10-11-27(25,26)21-8-4-2-3-5-9-21/h6-7,12-13H,2-5,8-11,14H2,1H3,(H,23,24)/b7-6+ |
| InChIKey |
YUSCTNYJZXBTGL-VOTSOKGWSA-N |
| NMR Offset |
15.5012 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_11628_3466 |
| 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: F17747; Labnumber: MEDZ-04307 |
![2-butenoic acid, 4-[[2-[(hexahydro-1H-azepin-1-yl)sulfonyl]ethyl][(1-methyl-1H-pyrazol-4-yl)methyl]amino]-4-oxo-, (2E)-](/api/spectrum/Bg3iSe8425i/structure.png?h=300&w=458 "2-butenoic acid, 4-[[2-[(hexahydro-1H-azepin-1-yl)sulfonyl]ethyl][(1-methyl-1H-pyrazol-4-yl)methyl]amino]-4-oxo-, (2E)-")
