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1,3-bis(4-ethoxyphenyl)-2-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium perchlorate
SpectraBase Compound ID K5eatLLjQ2r
InChI InChI=1S/C25H31N2O2.ClHO4/c1-4-28-22-14-10-20(11-15-22)25-19(3)27(24-9-7-6-8-18-26(24)25)21-12-16-23(17-13-21)29-5-2;2-1(3,4)5/h10-17H,4-9,18H2,1-3H3;(H,2,3,4,5)/q+1;/p-1
InChIKey KBZYZXHTBUNKMK-UHFFFAOYSA-M
Mol Weight 490.98 g/mol
Molecular Formula C25H31ClN2O6
Exact Mass 490.187064 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HC2NxPojCeB
Name 1,3-bis(4-ethoxyphenyl)-2-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium 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/C25H31N2O2.ClHO4/c1-4-28-22-14-10-20(11-15-22)25-19(3)27(24-9-7-6-8-18-26(24)25)21-12-16-23(17-13-21)29-5-2;2-1(3,4)5/h10-17H,4-9,18H2,1-3H3;(H,2,3,4,5)/q+1;/p-1
InChIKey KBZYZXHTBUNKMK-UHFFFAOYSA-M
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_5925
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: 121828; Labnumber: EX00112201; VK_ID: VK-005928
Temperature 308 °C