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3-(4-chlorophenyl)-1-(cyanomethyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium chloride
SpectraBase Compound ID 5YJuSbanp9Z
InChI InChI=1S/C14H13ClN3.ClH/c15-12-5-3-11(4-6-12)13-10-17(9-7-16)14-2-1-8-18(13)14;/h3-6,10H,1-2,8-9H2;1H/q+1;/p-1
InChIKey IMQYNYSDHLKZPL-UHFFFAOYSA-M
Mol Weight 294.18 g/mol
Molecular Formula C14H13Cl2N3
Exact Mass 293.048653 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IKkq2oaGfUM
Name 3-(4-chlorophenyl)-1-(cyanomethyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium 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/C14H13ClN3.ClH/c15-12-5-3-11(4-6-12)13-10-17(9-7-16)14-2-1-8-18(13)14;/h3-6,10H,1-2,8-9H2;1H/q+1;/p-1
InChIKey IMQYNYSDHLKZPL-UHFFFAOYSA-M
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28474
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: D87883; Labnumber: SC_0087-1006; SBI_ID: SBI-028478
Temperature 318 °C