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N-[3-(aminocarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl]-5-methyl-3-phenyl-4-isoxazolecarboxamide
SpectraBase Compound ID 9rUd7mrTOvC
InChI InChI=1S/C22H23N3O3S/c1-13-17(19(25-28-13)14-9-5-4-6-10-14)21(27)24-22-18(20(23)26)15-11-7-2-3-8-12-16(15)29-22/h4-6,9-10H,2-3,7-8,11-12H2,1H3,(H2,23,26)(H,24,27)
InChIKey NLSKWKMKDKHKLM-UHFFFAOYSA-N
Mol Weight 409.5 g/mol
Molecular Formula C22H23N3O3S
Exact Mass 409.146013 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ECpBYRjSR02
Name N-[3-(aminocarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl]-5-methyl-3-phenyl-4-isoxazolecarboxamide
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/C22H23N3O3S/c1-13-17(19(25-28-13)14-9-5-4-6-10-14)21(27)24-22-18(20(23)26)15-11-7-2-3-8-12-16(15)29-22/h4-6,9-10H,2-3,7-8,11-12H2,1H3,(H2,23,26)(H,24,27)
InChIKey NLSKWKMKDKHKLM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_13417
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/8069514; Labnumber: NSB0029900; UZI_ID: UZI-013421
Temperature 313 °C