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6-Bromo-2-[(4-carbethoxy-4-phenyl-piperidino)methyl]-5-methoxy-1-phenyl-indole-3-carboxylic acid ethyl ester
SpectraBase Compound ID 8mZfG1YVdL4
InChI InChI=1S/C33H35BrN2O5/c1-4-40-31(37)30-25-20-29(39-3)26(34)21-27(25)36(24-14-10-7-11-15-24)28(30)22-35-18-16-33(17-19-35,32(38)41-5-2)23-12-8-6-9-13-23/h6-15,20-21H,4-5,16-19,22H2,1-3H3
InChIKey ILQTXCFJXBKHTD-UHFFFAOYSA-N
Mol Weight 619.6 g/mol
Molecular Formula C33H35BrN2O5
Exact Mass 618.172935 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DYRWc1zRGxp
Name 1H-indole-3-carboxylic acid, 6-bromo-2-[[4-(ethoxycarbonyl)-4-phenyl-1-piperidinyl]methyl]-5-methoxy-1-phenyl-, 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 618.172935230 u
Formula C33H35BrN2O5
InChI InChI=1S/C33H35BrN2O5/c1-4-40-31(37)30-25-20-29(39-3)26(34)21-27(25)36(24-14-10-7-11-15-24)28(30)22-35-18-16-33(17-19-35,32(38)41-5-2)23-12-8-6-9-13-23/h6-15,20-21H,4-5,16-19,22H2,1-3H3
InChIKey ILQTXCFJXBKHTD-UHFFFAOYSA-N
Molecular Weight 619.556 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_421
Solvent DMSO-d6
Source Vendor ID: NMR/8305750; Lab Info: JNR; Lab Number: JMR-D000412
Temperature 23.85 °C