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tert-butyl 2-{[(E)-(2-hydroxy-5-iodophenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
SpectraBase Compound ID F1RP0tYqjaO
InChI InChI=1S/C20H23IN2O3S/c1-20(2,3)26-19(25)17-14-7-8-23(4)11-16(14)27-18(17)22-10-12-9-13(21)5-6-15(12)24/h5-6,9-10,24H,7-8,11H2,1-4H3/b22-10+
InChIKey SHABMJKYKATVBU-LSHDLFTRSA-N
Mol Weight 498.38 g/mol
Molecular Formula C20H23IN2O3S
Exact Mass 498.047409 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BFbyrFfu6Jq
Name tert-butyl 2-{[(E)-(2-hydroxy-5-iodophenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-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/C20H23IN2O3S/c1-20(2,3)26-19(25)17-14-7-8-23(4)11-16(14)27-18(17)22-10-12-9-13(21)5-6-15(12)24/h5-6,9-10,24H,7-8,11H2,1-4H3/b22-10+
InChIKey SHABMJKYKATVBU-LSHDLFTRSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2171
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/8039671; UBI_ID: UBI-002172
Synonyms tert-butyl 2-{[(2-hydroxy-5-iodophenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Temperature 308 °C