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6-({[3-(aminocarbonyl)-5,6-dihydro-4H-cyclopenta[b]thien-2-yl]amino}carbonyl)-3-cyclohexene-1-carboxylic acid
SpectraBase Compound ID FjrUjIuAN7
InChI InChI=1S/C16H18N2O4S/c17-13(19)12-10-6-3-7-11(10)23-15(12)18-14(20)8-4-1-2-5-9(8)16(21)22/h1-2,8-9H,3-7H2,(H2,17,19)(H,18,20)(H,21,22)
InChIKey IVNSPHHAGLJRNW-UHFFFAOYSA-N
Mol Weight 334.39 g/mol
Molecular Formula C16H18N2O4S
Exact Mass 334.098728 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E81A76HA0yt
Name 6-({[3-(aminocarbonyl)-5,6-dihydro-4H-cyclopenta[b]thien-2-yl]amino}carbonyl)-3-cyclohexene-1-carboxylic 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/C16H18N2O4S/c17-13(19)12-10-6-3-7-11(10)23-15(12)18-14(20)8-4-1-2-5-9(8)16(21)22/h1-2,8-9H,3-7H2,(H2,17,19)(H,18,20)(H,21,22)
InChIKey IVNSPHHAGLJRNW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18640
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/9126054; UBI_ID: UBI-018643
Temperature 318 °C