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4H-cyclohepta[b]thiophene-3-carboxylic acid, 5,6,7,8-tetrahydro-2-[[(2-oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino]-, ethyl ester

View entire compound with spectra: 1 NMR

4H-cyclohepta[b]thiophene-3-carboxylic acid, 5,6,7,8-tetrahydro-2-[[(2-oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino]-, ethyl ester
SpectraBase Compound ID DSTO4cDWMkB
InChI InChI=1S/C22H29NO5S/c1-2-27-21(26)18-14-9-5-3-6-10-16(14)29-20(18)23-19(25)15-13-17(24)28-22(15)11-7-4-8-12-22/h15H,2-13H2,1H3,(H,23,25)
InChIKey OYPJVRNSQJPEPE-UHFFFAOYSA-N
Mol Weight 419.54 g/mol
Molecular Formula C22H29NO5S
Exact Mass 419.176644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FJhZYSR0aXr
Name 4H-cyclohepta[b]thiophene-3-carboxylic acid, 5,6,7,8-tetrahydro-2-[[(2-oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 419.176644207 u
Formula C22H29NO5S
InChI InChI=1S/C22H29NO5S/c1-2-27-21(26)18-14-9-5-3-6-10-16(14)29-20(18)23-19(25)15-13-17(24)28-22(15)11-7-4-8-12-22/h15H,2-13H2,1H3,(H,23,25)
InChIKey OYPJVRNSQJPEPE-UHFFFAOYSA-N
Molecular Weight 419.536 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17442
Solvent DMSO-d6
Source Vendor ID: NMR/11270601; Lab Info: ART; Lab Number: CG-3785