3-[(4-bromophenoxy)methyl]-N-(3-cyano-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thien-2-yl)benzamide

SpectraBase Compound ID	7mDscN6iNXG
InChI	InChI=1S/C29H31BrN2O2S/c30-23-14-16-24(17-15-23)34-20-21-10-9-11-22(18-21)28(33)32-29-26(19-31)25-12-7-5-3-1-2-4-6-8-13-27(25)35-29/h9-11,14-18H,1-8,12-13,20H2,(H,32,33)
InChIKey	INKIWPBHVPORSM-UHFFFAOYSA-N Google Search
Mol Weight	551.54 g/mol
Molecular Formula	C29H31BrN2O2S
Exact Mass	550.128962 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	7ZoxLF7yxiI
Name	3-[(4-bromophenoxy)methyl]-N-(3-cyano-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thien-2-yl)benzamide
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/C29H31BrN2O2S/c30-23-14-16-24(17-15-23)34-20-21-10-9-11-22(18-21)28(33)32-29-26(19-31)25-12-7-5-3-1-2-4-6-8-13-27(25)35-29/h9-11,14-18H,1-8,12-13,20H2,(H,32,33)
InChIKey	INKIWPBHVPORSM-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_11116
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/1023576; Labnumber: MVY0314; UZI_ID: UZI-011118
Temperature	308 °C