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benzeneethanamine, N-[5-[4-(3-fluorobenzoyl)-1-piperazinyl]-2-nitrophenyl]-3,4-dimethoxy-
SpectraBase Compound ID 11hwwIdjO4D
InChI InChI=1S/C27H29FN4O5/c1-36-25-9-6-19(16-26(25)37-2)10-11-29-23-18-22(7-8-24(23)32(34)35)30-12-14-31(15-13-30)27(33)20-4-3-5-21(28)17-20/h3-9,16-18,29H,10-15H2,1-2H3
InChIKey OCPJWLIIMOOVGL-UHFFFAOYSA-N
Mol Weight 508.55 g/mol
Molecular Formula C27H29FN4O5
Exact Mass 508.212198 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Iikpvzhf0nv
Name benzeneethanamine, N-[5-[4-(3-fluorobenzoyl)-1-piperazinyl]-2-nitrophenyl]-3,4-dimethoxy-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 508.212198208 u
Formula C27H29FN4O5
InChI InChI=1S/C27H29FN4O5/c1-36-25-9-6-19(16-26(25)37-2)10-11-29-23-18-22(7-8-24(23)32(34)35)30-12-14-31(15-13-30)27(33)20-4-3-5-21(28)17-20/h3-9,16-18,29H,10-15H2,1-2H3
InChIKey OCPJWLIIMOOVGL-UHFFFAOYSA-N
Molecular Weight 508.550 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9271
Solvent DMSO-d6
Source Vendor ID: NMR/10240354; Lab Info: LP; Lab Number: LP-2501257
Temperature 29.85 °C