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(2E)-4-{[3-(ethoxycarbonyl)-5-isopropyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl]amino}-4-oxo-2-butenoic acid
SpectraBase Compound ID 44MA244tvuP
InChI InChI=1S/C17H21NO6S/c1-4-23-17(22)15-10-7-11(9(2)3)24-8-12(10)25-16(15)18-13(19)5-6-14(20)21/h5-6,9,11H,4,7-8H2,1-3H3,(H,18,19)(H,20,21)/b6-5+
InChIKey OSCOUEYRVLSPSU-AATRIKPKSA-N
Mol Weight 367.42 g/mol
Molecular Formula C17H21NO6S
Exact Mass 367.108959 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GKwMCOcIHEg
Name (2E)-4-{[3-(ethoxycarbonyl)-5-isopropyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl]amino}-4-oxo-2-butenoic acid
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 367.108958568 u
Formula C17H21NO6S
InChI InChI=1S/C17H21NO6S/c1-4-23-17(22)15-10-7-11(9(2)3)24-8-12(10)25-16(15)18-13(19)5-6-14(20)21/h5-6,9,11H,4,7-8H2,1-3H3,(H,18,19)(H,20,21)/b6-5+
InChIKey OSCOUEYRVLSPSU-AATRIKPKSA-N
Molecular Weight 367.416 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2033
Solvent DMSO-d6
Source Vendor ID: NMR/12278802