2-benzyl-4,8-diethoxy-1,3-dimethylcyclohepta[c]pyrrolium perchlorate

SpectraBase Compound ID	72e1bS3YHhw
InChI	InChI=1S/C22H26NO2.ClHO4/c1-5-24-19-13-10-14-20(25-6-2)22-17(4)23(16(3)21(19)22)15-18-11-8-7-9-12-18;2-1(3,4)5/h7-14H,5-6,15H2,1-4H3;(H,2,3,4,5)/q+1;/p-1
InChIKey	FNIJMJRKGSHTRR-UHFFFAOYSA-M Google Search
Mol Weight	435.9 g/mol
Molecular Formula	C22H26ClNO6
Exact Mass	435.144865 g/mol

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SpectraBase Spectrum ID	1cX2bzWRhiL
Name	2-benzyl-4,8-diethoxy-1,3-dimethylcyclohepta[c]pyrrolium perchlorate
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/C22H26NO2.ClHO4/c1-5-24-19-13-10-14-20(25-6-2)22-17(4)23(16(3)21(19)22)15-18-11-8-7-9-12-18;2-1(3,4)5/h7-14H,5-6,15H2,1-4H3;(H,2,3,4,5)/q+1;/p-1
InChIKey	FNIJMJRKGSHTRR-UHFFFAOYSA-M
NMR Offset	15.3548
NMR Spectrometer Frequency	300.133
Observed nucleus	1H
Origin	1H_UBI-VK_18310_4159
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	CDCl3
Source File Reference	VendorID: 120985; Labnumber: RRTK-0107; VK_ID: VK-004160
Temperature	318 °C