1-{3-[(4-ethoxyphenoxy)methyl]benzoyl}hexahydro-1H-azepine

SpectraBase Compound ID	JkCzKHrlj5H
InChI	InChI=1S/C22H27NO3/c1-2-25-20-10-12-21(13-11-20)26-17-18-8-7-9-19(16-18)22(24)23-14-5-3-4-6-15-23/h7-13,16H,2-6,14-15,17H2,1H3
InChIKey	MFUXQBMFODKYNP-UHFFFAOYSA-N Google Search
Mol Weight	353.46 g/mol
Molecular Formula	C22H27NO3
Exact Mass	353.199094 g/mol

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SpectraBase Spectrum ID	KPuZD7ucAYh
Name	1-{3-[(4-ethoxyphenoxy)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/C22H27NO3/c1-2-25-20-10-12-21(13-11-20)26-17-18-8-7-9-19(16-18)22(24)23-14-5-3-4-6-15-23/h7-13,16H,2-6,14-15,17H2,1H3
InChIKey	MFUXQBMFODKYNP-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_377
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/9059284; Labnumber: 619-0001478; UZI_ID: UZI-000378
Temperature	318 °C