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5-{[3-(aminocarbonyl)-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}-5-oxopentanoic acid
SpectraBase Compound ID 4IgbKB4hnT5
InChI InChI=1S/C16H22N2O4S/c1-2-9-6-7-10-11(8-9)23-16(14(10)15(17)22)18-12(19)4-3-5-13(20)21/h9H,2-8H2,1H3,(H2,17,22)(H,18,19)(H,20,21)
InChIKey YPYUXYGSMYLXGI-UHFFFAOYSA-N
Mol Weight 338.42 g/mol
Molecular Formula C16H22N2O4S
Exact Mass 338.130028 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FbAVliFfBD6
Name 5-{[3-(aminocarbonyl)-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}-5-oxopentanoic acid
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/C16H22N2O4S/c1-2-9-6-7-10-11(8-9)23-16(14(10)15(17)22)18-12(19)4-3-5-13(20)21/h9H,2-8H2,1H3,(H2,17,22)(H,18,19)(H,20,21)
InChIKey YPYUXYGSMYLXGI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20380
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/9163437; UBI_ID: UBI-020384
Temperature 318 °C