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6-Bromanyl-3-ethoxycarbonyl-2-methyl-1-phenyl-4-(piperidin-1-ium-1-ylmethyl)indol-5-olate
SpectraBase Compound ID KWHfIecVKDw
InChI InChI=1S/C24H27BrN2O3/c1-3-30-24(29)21-16(2)27(17-10-6-4-7-11-17)20-14-19(25)23(28)18(22(20)21)15-26-12-8-5-9-13-26/h4,6-7,10-11,14,28H,3,5,8-9,12-13,15H2,1-2H3
InChIKey HFHPGVWSPQSRDS-UHFFFAOYSA-N
Mol Weight 471.4 g/mol
Molecular Formula C24H27BrN2O3
Exact Mass 470.120506 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ei6bO0RFW3u
Name 1H-indole-3-carboxylic acid, 6-bromo-5-hydroxy-2-methyl-1-phenyl-4-(1-piperidinylmethyl)-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.120505734 u
Formula C24H27BrN2O3
InChI InChI=1S/C24H27BrN2O3/c1-3-30-24(29)21-16(2)27(17-10-6-4-7-11-17)20-14-19(25)23(28)18(22(20)21)15-26-12-8-5-9-13-26/h4,6-7,10-11,14,28H,3,5,8-9,12-13,15H2,1-2H3
InChIKey HFHPGVWSPQSRDS-UHFFFAOYSA-N
Molecular Weight 471.395 g/mol
NMR Offset 14.5168
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1427
Solvent CDCl3
Source Vendor ID: ZI/8128673; Lab Info: JMR; Lab Number: JMR-0001598
Temperature 23.85 °C