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1-[2-(morpholin-4-ium-4-yl)ethyl]-2-{[(3,4,5-trimethoxyphenyl)methyl]amino}-2,3-dihydro-1H-1,3-benzodiazol-2-ylium dichloride

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1-[2-(morpholin-4-ium-4-yl)ethyl]-2-{[(3,4,5-trimethoxyphenyl)methyl]amino}-2,3-dihydro-1H-1,3-benzodiazol-2-ylium dichloride
SpectraBase Compound ID IuZZWFjyH5l
InChI InChI=1S/C23H32N4O4.2ClH/c1-28-20-14-17(15-21(29-2)22(20)30-3)16-24-23-25-18-6-4-5-7-19(18)27(23)9-8-26-10-12-31-13-11-26;;/h4-7,14-15,24-26H,8-13,16H2,1-3H3;2*1H/q+1;;/p-2
InChIKey WQNWPMRCFPVRNC-UHFFFAOYSA-L
Mol Weight 499.44 g/mol
Molecular Formula C23H32Cl2N4O4
Exact Mass 498.180061 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1yuUmjKEWEg
Name 1-[2-(morpholin-4-ium-4-yl)ethyl]-2-{[(3,4,5-trimethoxyphenyl)methyl]amino}-2,3-dihydro-1H-1,3-benzodiazol-2-ylium dichloride
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/C23H32N4O4.2ClH/c1-28-20-14-17(15-21(29-2)22(20)30-3)16-24-23-25-18-6-4-5-7-19(18)27(23)9-8-26-10-12-31-13-11-26;;/h4-7,14-15,24-26H,8-13,16H2,1-3H3;2*1H/q+1;;/p-2
InChIKey WQNWPMRCFPVRNC-UHFFFAOYSA-L
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12927
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: D77461; Labnumber: RRYK-790; SBI_ID: SBI-012930
Temperature 308 °C