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1,4-Benzodioxin-6-sulfonamide, N-(4-fluorophenyl)-N-[2-(hexahydro-1H-azepin-1-yl)-2-oxoethyl]-2,3-dihydro-
SpectraBase Compound ID 8rL3VoPTsVV
InChI InChI=1S/C22H25FN2O5S/c23-17-5-7-18(8-6-17)25(16-22(26)24-11-3-1-2-4-12-24)31(27,28)19-9-10-20-21(15-19)30-14-13-29-20/h5-10,15H,1-4,11-14,16H2
InChIKey KBUORTNJUKXCCI-UHFFFAOYSA-N
Mol Weight 448.51 g/mol
Molecular Formula C22H25FN2O5S
Exact Mass 448.146821 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3hz3BTI9JpN
Name N-(4-fluorophenyl)-N-(2-hexahydro-1H-azepin-1-yl-2-oxoethyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide
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/C22H25FN2O5S/c23-17-5-7-18(8-6-17)25(16-22(26)24-11-3-1-2-4-12-24)31(27,28)19-9-10-20-21(15-19)30-14-13-29-20/h5-10,15H,1-4,11-14,16H2
InChIKey KBUORTNJUKXCCI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7989
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: D47979; Labnumber: SPDEM4-5449; SBI_ID: SBI-007992
Temperature 308 °C