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benzenepropanamine, N-[5-[4-(2-fluorobenzoyl)-1-piperazinyl]-2-nitrophenyl]-alpha-methyl-
SpectraBase Compound ID A3jon489HQU
InChI InChI=1S/C27H29FN4O3/c1-20(11-12-21-7-3-2-4-8-21)29-25-19-22(13-14-26(25)32(34)35)30-15-17-31(18-16-30)27(33)23-9-5-6-10-24(23)28/h2-10,13-14,19-20,29H,11-12,15-18H2,1H3
InChIKey QEHVSUWHUQFFAB-UHFFFAOYSA-N
Mol Weight 476.55 g/mol
Molecular Formula C27H29FN4O3
Exact Mass 476.222369 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ECA855Ok8mC
Name benzenepropanamine, N-[5-[4-(2-fluorobenzoyl)-1-piperazinyl]-2-nitrophenyl]-alpha-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 476.222368970 u
Formula C27H29FN4O3
InChI InChI=1S/C27H29FN4O3/c1-20(11-12-21-7-3-2-4-8-21)29-25-19-22(13-14-26(25)32(34)35)30-15-17-31(18-16-30)27(33)23-9-5-6-10-24(23)28/h2-10,13-14,19-20,29H,11-12,15-18H2,1H3
InChIKey QEHVSUWHUQFFAB-UHFFFAOYSA-N
Molecular Weight 476.552 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6857
Solvent DMSO-d6
Source Vendor ID: NMR/9321051; Lab Info: LP; Lab Number: LP-2501074
Temperature 23.85 °C