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9-{[4-(2-fluorophenyl)-1-piperazinyl]carbonyl}-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidin-12-one
SpectraBase Compound ID 7WqFMdGtLoY
InChI InChI=1S/C25H23FN4O2S/c26-18-6-2-3-7-19(18)28-11-13-29(14-12-28)24(31)16-9-10-21-27-23-22(25(32)30(21)15-16)17-5-1-4-8-20(17)33-23/h2-3,6-7,9-10,15H,1,4-5,8,11-14H2
InChIKey ACIICWPXNZPTEN-UHFFFAOYSA-N
Mol Weight 462.54 g/mol
Molecular Formula C25H23FN4O2S
Exact Mass 462.152575 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DxJUMEN6gcF
Name 9-{[4-(2-fluorophenyl)-1-piperazinyl]carbonyl}-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidin-12-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 462.152575332 u
Formula C25H23FN4O2S
InChI InChI=1S/C25H23FN4O2S/c26-18-6-2-3-7-19(18)28-11-13-29(14-12-28)24(31)16-9-10-21-27-23-22(25(32)30(21)15-16)17-5-1-4-8-20(17)33-23/h2-3,6-7,9-10,15H,1,4-5,8,11-14H2
InChIKey ACIICWPXNZPTEN-UHFFFAOYSA-N
Molecular Weight 462.543 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7764
Solvent DMSO-d6
Source Vendor ID: NMR/13218465