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2-{[2-(4-allyl-2-methoxyphenoxy)propanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
SpectraBase Compound ID A1LZGkPjaZ2
InChI InChI=1S/C23H28N2O4S/c1-4-8-15-11-12-17(18(13-15)28-3)29-14(2)22(27)25-23-20(21(24)26)16-9-6-5-7-10-19(16)30-23/h4,11-14H,1,5-10H2,2-3H3,(H2,24,26)(H,25,27)
InChIKey QNVUCKVFFGYTRZ-UHFFFAOYSA-N
Mol Weight 428.55 g/mol
Molecular Formula C23H28N2O4S
Exact Mass 428.176979 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ZDqmczaK94
Name 2-{[2-(4-allyl-2-methoxyphenoxy)propanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-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/C23H28N2O4S/c1-4-8-15-11-12-17(18(13-15)28-3)29-14(2)22(27)25-23-20(21(24)26)16-9-6-5-7-10-19(16)30-23/h4,11-14H,1,5-10H2,2-3H3,(H2,24,26)(H,25,27)
InChIKey QNVUCKVFFGYTRZ-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5803
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/8175076; UBI_ID: UBI-005805
Temperature 313 °C