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3H-indolium, 2-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]-5-(methoxycarbonyl)-1,3,3-trimethyl-, iodide
SpectraBase Compound ID 2M4DqHShzRu
InChI InChI=1S/C23H27N2O2.HI/c1-23(2)19-15-17(22(26)27-6)10-13-20(19)25(5)21(23)14-9-16-7-11-18(12-8-16)24(3)4;/h7-15H,1-6H3;1H/q+1;/p-1
InChIKey WMPMHZOBYHOSOD-UHFFFAOYSA-M
Mol Weight 490.39 g/mol
Molecular Formula C23H27IN2O2
Exact Mass 490.111723 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6bwiBDQ8zDI
Name 3H-indolium, 2-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]-5-(methoxycarbonyl)-1,3,3-trimethyl-, iodide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 490.111723115 u
Formula C23H27IN2O2
InChI InChI=1S/C23H27N2O2.HI/c1-23(2)19-15-17(22(26)27-6)10-13-20(19)25(5)21(23)14-9-16-7-11-18(12-8-16)24(3)4;/h7-15H,1-6H3;1H/q+1;/p-1
InChIKey WMPMHZOBYHOSOD-UHFFFAOYSA-M
Molecular Weight 490.385 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7726
Solvent DMSO-d6
Source Vendor ID: NMR/13308540