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4-chloro-1-ethyl-N-[4-(hexahydro-1H-azepin-1-ylsulfonyl)phenyl]-1H-pyrazole-3-carboxamide
SpectraBase Compound ID BAsi6XmxHcf
InChI InChI=1S/C18H23ClN4O3S/c1-2-22-13-16(19)17(21-22)18(24)20-14-7-9-15(10-8-14)27(25,26)23-11-5-3-4-6-12-23/h7-10,13H,2-6,11-12H2,1H3,(H,20,24)
InChIKey RFKXFHYHBDEEBR-UHFFFAOYSA-N
Mol Weight 410.92 g/mol
Molecular Formula C18H23ClN4O3S
Exact Mass 410.117939 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4mn1Kbm84jb
Name 4-chloro-1-ethyl-N-[4-(hexahydro-1H-azepin-1-ylsulfonyl)phenyl]-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/C18H23ClN4O3S/c1-2-22-13-16(19)17(21-22)18(24)20-14-7-9-15(10-8-14)27(25,26)23-11-5-3-4-6-12-23/h7-10,13H,2-6,11-12H2,1H3,(H,20,24)
InChIKey RFKXFHYHBDEEBR-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18885
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/9130936; UBI_ID: UBI-018888
Temperature 308 °C