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1-{3-[(2-chlorophenoxy)methyl]benzoyl}hexahydro-1H-azepine

View entire compound with spectra: 1 NMR

1-{3-[(2-chlorophenoxy)methyl]benzoyl}hexahydro-1H-azepine
SpectraBase Compound ID Dp7CF37dtbw
InChI InChI=1S/C20H22ClNO2/c21-18-10-3-4-11-19(18)24-15-16-8-7-9-17(14-16)20(23)22-12-5-1-2-6-13-22/h3-4,7-11,14H,1-2,5-6,12-13,15H2
InChIKey FMRNIECFCKFNFP-UHFFFAOYSA-N
Mol Weight 343.85 g/mol
Molecular Formula C20H22ClNO2
Exact Mass 343.133907 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4nnmTJlL1ya
Name 1-{3-[(2-chlorophenoxy)methyl]benzoyl}hexahydro-1H-azepine
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/C20H22ClNO2/c21-18-10-3-4-11-19(18)24-15-16-8-7-9-17(14-16)20(23)22-12-5-1-2-6-13-22/h3-4,7-11,14H,1-2,5-6,12-13,15H2
InChIKey FMRNIECFCKFNFP-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_387
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/9063882; Labnumber: 619-0001549; UZI_ID: UZI-000388
Synonyms 2-chlorophenyl 3-(hexahydro-1H-azepin-1-ylcarbonyl)benzyl ether
Temperature 308 °C