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ethyl 2-[(phenoxyacetyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
SpectraBase Compound ID 7lR5K9TUuwJ
InChI InChI=1S/C25H33NO4S/c1-2-29-25(28)23-20-16-12-7-5-3-4-6-8-13-17-21(20)31-24(23)26-22(27)18-30-19-14-10-9-11-15-19/h9-11,14-15H,2-8,12-13,16-18H2,1H3,(H,26,27)
InChIKey JVTUTSLBXPQEMH-UHFFFAOYSA-N
Mol Weight 443.6 g/mol
Molecular Formula C25H33NO4S
Exact Mass 443.21303 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ALkcadnvpG
Name ethyl 2-[(phenoxyacetyl)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/C25H33NO4S/c1-2-29-25(28)23-20-16-12-7-5-3-4-6-8-13-17-21(20)31-24(23)26-22(27)18-30-19-14-10-9-11-15-19/h9-11,14-15H,2-8,12-13,16-18H2,1H3,(H,26,27)
InChIKey JVTUTSLBXPQEMH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20619
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/9130648; Labnumber: U_AM_ACK/055030; UZI_ID: UZI-020627
Temperature 318 °C