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ethyl 4-{[3-(2-fluorophenyl)-6-nitro-4-oxo-3,4-dihydro-2-quinazolinyl]methyl}-1-piperazinecarboxylate
SpectraBase Compound ID EhDGJ0cg9ja
InChI InChI=1S/C22H22FN5O5/c1-2-33-22(30)26-11-9-25(10-12-26)14-20-24-18-8-7-15(28(31)32)13-16(18)21(29)27(20)19-6-4-3-5-17(19)23/h3-8,13H,2,9-12,14H2,1H3
InChIKey NKBJJCPZYILOSK-UHFFFAOYSA-N
Mol Weight 455.45 g/mol
Molecular Formula C22H22FN5O5
Exact Mass 455.160497 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 999OZDOWItE
Name ethyl 4-{[3-(2-fluorophenyl)-6-nitro-4-oxo-3,4-dihydro-2-quinazolinyl]methyl}-1-piperazinecarboxylate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 455.160496986 u
Formula C22H22FN5O5
InChI InChI=1S/C22H22FN5O5/c1-2-33-22(30)26-11-9-25(10-12-26)14-20-24-18-8-7-15(28(31)32)13-16(18)21(29)27(20)19-6-4-3-5-17(19)23/h3-8,13H,2,9-12,14H2,1H3
InChIKey NKBJJCPZYILOSK-UHFFFAOYSA-N
Molecular Weight 455.446 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5402
Solvent DMSO-d6
Source Vendor ID: NMR/12319098