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4-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-ethylpyridinium iodide
SpectraBase Compound ID 9Qy18RBkEim
InChI InChI=1S/C16H16NO2.HI/c1-2-17-9-7-13(8-10-17)3-4-14-5-6-15-16(11-14)19-12-18-15;/h3-11H,2,12H2,1H3;1H/q+1;/p-1/b4-3+;
InChIKey GSJKHNKLCXJSDS-BJILWQEISA-M
Mol Weight 381.21 g/mol
Molecular Formula C16H16INO2
Exact Mass 381.022574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BTh8KcZZvQb
Name 4-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-ethylpyridinium iodide
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/C16H16NO2.HI/c1-2-17-9-7-13(8-10-17)3-4-14-5-6-15-16(11-14)19-12-18-15;/h3-11H,2,12H2,1H3;1H/q+1;/p-1/b4-3+;
InChIKey GSJKHNKLCXJSDS-BJILWQEISA-M
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16554
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: 987/00004048; Labnumber: 987/00004048218849; VK_ID: VK-016559
Synonyms 4-[2-(1,3-benzodioxol-5-yl)ethenyl]-1-ethylpyridinium iodide
Temperature 318 °C