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1-(2-hydroxy-3-(m-tolyloxy)propyl)-3-pentyl-1H-benzo[d]imidazol-2(3H)-iminium chloride
SpectraBase Compound ID HyXRxzVAwO6
InChI InChI=1S/C22H30N3O2.ClH/c1-3-4-7-13-24-20-11-5-6-12-21(20)25(22(24)23)15-18(26)16-27-19-10-8-9-17(2)14-19;/h5-6,8-12,14,18,26H,3-4,7,13,15-16,23H2,1-2H3;1H/q+1;/p-1
InChIKey SYROSCSWZCIYOY-UHFFFAOYSA-M
Mol Weight 403.95 g/mol
Molecular Formula C22H30ClN3O2
Exact Mass 403.202655 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 60gbAL2Su9F
Name 1-(2-hydroxy-3-(m-tolyloxy)propyl)-3-pentyl-1H-benzo[d]imidazol-2(3H)-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/C22H30N3O2.ClH/c1-3-4-7-13-24-20-11-5-6-12-21(20)25(22(24)23)15-18(26)16-27-19-10-8-9-17(2)14-19;/h5-6,8-12,14,18,26H,3-4,7,13,15-16,23H2,1-2H3;1H/q+1;/p-1
InChIKey SYROSCSWZCIYOY-UHFFFAOYSA-M
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11791
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: D63983; Labnumber: RRYK-621; SBI_ID: SBI-011794
Temperature 318 °C