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[5-(hexahydro-1H-azepin-1-ylcarbonyl)-2-furyl]methyl 4-iodophenyl ether
SpectraBase Compound ID 6M1I1tqrzE2
InChI InChI=1S/C18H20INO3/c19-14-5-7-15(8-6-14)22-13-16-9-10-17(23-16)18(21)20-11-3-1-2-4-12-20/h5-10H,1-4,11-13H2
InChIKey IWDXBFFKWRFMML-UHFFFAOYSA-N
Mol Weight 425.27 g/mol
Molecular Formula C18H20INO3
Exact Mass 425.048789 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LITIMYjqo0Y
Name [5-(hexahydro-1H-azepin-1-ylcarbonyl)-2-furyl]methyl 4-iodophenyl ether
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/C18H20INO3/c19-14-5-7-15(8-6-14)22-13-16-9-10-17(23-16)18(21)20-11-3-1-2-4-12-20/h5-10H,1-4,11-13H2
InChIKey IWDXBFFKWRFMML-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16454
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/8119359; UBI_ID: UBI-016457
Synonyms 1-{5-[(4-iodophenoxy)methyl]-2-furoyl}hexahydro-1H-azepine
Temperature 308 °C