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1-butyl-3-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-1,3-dihydro-2H-benzimidazol-2-iminium chloride
SpectraBase Compound ID FJgfiTlNFV1
InChI InChI=1S/C21H27N3O3.ClH/c1-3-4-13-23-17-9-5-6-10-18(17)24(21(23)22)14-16(25)15-27-20-12-8-7-11-19(20)26-2;/h5-12,16,22,25H,3-4,13-15H2,1-2H3;1H
InChIKey FFZKQDNNSGBGIS-UHFFFAOYSA-N
Mol Weight 405.93 g/mol
Molecular Formula C21H28ClN3O3
Exact Mass 405.181919 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B6oRV1EmahN
Name 1-butyl-3-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-1,3-dihydro-2H-benzimidazol-2-iminium chloride
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/C21H27N3O3.ClH/c1-3-4-13-23-17-9-5-6-10-18(17)24(21(23)22)14-16(25)15-27-20-12-8-7-11-19(20)26-2;/h5-12,16,22,25H,3-4,13-15H2,1-2H3;1H
InChIKey FFZKQDNNSGBGIS-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22347
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: D59311; Labnumber: RRYK-617; SBI_ID: SBI-022351
Temperature 308 °C