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N-[4-(hexahydro-1H-azepin-1-ylsulfonyl)phenyl]-1-methyl-1H-pyrazole-3-carboxamide
SpectraBase Compound ID 4HLrSCkohmO
InChI InChI=1S/C17H22N4O3S/c1-20-13-10-16(19-20)17(22)18-14-6-8-15(9-7-14)25(23,24)21-11-4-2-3-5-12-21/h6-10,13H,2-5,11-12H2,1H3,(H,18,22)
InChIKey XYDKYWNZWIPRJB-UHFFFAOYSA-N
Mol Weight 362.45 g/mol
Molecular Formula C17H22N4O3S
Exact Mass 362.141262 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7JxyWSGqF5M
Name N-[4-(hexahydro-1H-azepin-1-ylsulfonyl)phenyl]-1-methyl-1H-pyrazole-3-carboxamide
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/C17H22N4O3S/c1-20-13-10-16(19-20)17(22)18-14-6-8-15(9-7-14)25(23,24)21-11-4-2-3-5-12-21/h6-10,13H,2-5,11-12H2,1H3,(H,18,22)
InChIKey XYDKYWNZWIPRJB-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_5587
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/9169705; Labnumber: B_AMK_AC/4120; UZI_ID: UZI-005589
Temperature 308 °C