For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-{4-[(4-tert-butylphenoxy)methyl]benzoyl}hexahydro-1H-azepine
SpectraBase Compound ID 1imgF64iT9z
InChI InChI=1S/C24H31NO2/c1-24(2,3)21-12-14-22(15-13-21)27-18-19-8-10-20(11-9-19)23(26)25-16-6-4-5-7-17-25/h8-15H,4-7,16-18H2,1-3H3
InChIKey LJDXWYMIGOIHFS-UHFFFAOYSA-N
Mol Weight 365.52 g/mol
Molecular Formula C24H31NO2
Exact Mass 365.235479 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID jObrEBbMI9
Name 1-{4-[(4-tert-butylphenoxy)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/C24H31NO2/c1-24(2,3)21-12-14-22(15-13-21)27-18-19-8-10-20(11-9-19)23(26)25-16-6-4-5-7-17-25/h8-15H,4-7,16-18H2,1-3H3
InChIKey LJDXWYMIGOIHFS-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8815
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/9036542; UBI_ID: UBI-008818
Synonyms 4-tert-butylphenyl 4-(hexahydro-1H-azepin-1-ylcarbonyl)benzyl ether
Temperature 308 °C