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methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID DlHgjQdrWt6
InChI InChI=1S/C14H14IN3O3S/c1-18-11(8(15)6-16-18)12(19)17-13-10(14(20)21-2)7-4-3-5-9(7)22-13/h6H,3-5H2,1-2H3,(H,17,19)
InChIKey OLKZAGYZZVJSDH-UHFFFAOYSA-N
Mol Weight 431.25 g/mol
Molecular Formula C14H14IN3O3S
Exact Mass 430.980057 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3sZ41nca5Do
Name methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
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/C14H14IN3O3S/c1-18-11(8(15)6-16-18)12(19)17-13-10(14(20)21-2)7-4-3-5-9(7)22-13/h6H,3-5H2,1-2H3,(H,17,19)
InChIKey OLKZAGYZZVJSDH-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_1005
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/1140229; Labnumber: AC-NHALL/0417417; UZI_ID: UZI-001007
Temperature 308 °C