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ethyl 2-[(4-nitrobenzoyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
SpectraBase Compound ID LCkVrPPQIFU
InChI InChI=1S/C24H30N2O5S/c1-2-31-24(28)21-19-11-9-7-5-3-4-6-8-10-12-20(19)32-23(21)25-22(27)17-13-15-18(16-14-17)26(29)30/h13-16H,2-12H2,1H3,(H,25,27)
InChIKey ZLQUYLGDLLXZEX-UHFFFAOYSA-N
Mol Weight 458.57 g/mol
Molecular Formula C24H30N2O5S
Exact Mass 458.187543 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KcZXkp6RMjQ
Name ethyl 2-[(4-nitrobenzoyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
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/C24H30N2O5S/c1-2-31-24(28)21-19-11-9-7-5-3-4-6-8-10-12-20(19)32-23(21)25-22(27)17-13-15-18(16-14-17)26(29)30/h13-16H,2-12H2,1H3,(H,25,27)
InChIKey ZLQUYLGDLLXZEX-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_636
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/6187203; UBI_ID: UBI-000637
Temperature 308 °C