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2-amino-4-{5-[(4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
SpectraBase Compound ID H45cEO9fkXh
InChI InChI=1S/C27H28FN3O/c1-17-13-18(2)23(14-19(17)16-32-21-11-9-20(28)10-12-21)26-22-7-5-3-4-6-8-25(22)31-27(30)24(26)15-29/h9-14H,3-8,16H2,1-2H3,(H2,30,31)
InChIKey ZTYRJLIDPQAWCK-UHFFFAOYSA-N
Mol Weight 429.54 g/mol
Molecular Formula C27H28FN3O
Exact Mass 429.221641 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C02QKTz4AnH
Name 2-amino-4-{5-[(4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
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/C27H28FN3O/c1-17-13-18(2)23(14-19(17)16-32-21-11-9-20(28)10-12-21)26-22-7-5-3-4-6-8-25(22)31-27(30)24(26)15-29/h9-14H,3-8,16H2,1-2H3,(H2,30,31)
InChIKey ZTYRJLIDPQAWCK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18295
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/1029838; Labnumber: TSI4035; UZI_ID: UZI-018302
Temperature 318 °C