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ethyl 4-{2,5-dioxo-3-[4-(2-pyrimidinyl)-1-piperazinyl]-1-pyrrolidinyl}benzoate
SpectraBase Compound ID FgOMDQej4Ek
InChI InChI=1S/C21H23N5O4/c1-2-30-20(29)15-4-6-16(7-5-15)26-18(27)14-17(19(26)28)24-10-12-25(13-11-24)21-22-8-3-9-23-21/h3-9,17H,2,10-14H2,1H3
InChIKey XIPGCMPIHSEWAP-UHFFFAOYSA-N
Mol Weight 409.45 g/mol
Molecular Formula C21H23N5O4
Exact Mass 409.175004 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3mOlK1QrqzA
Name ethyl 4-{2,5-dioxo-3-[4-(2-pyrimidinyl)-1-piperazinyl]-1-pyrrolidinyl}benzoate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.175004237 u
Formula C21H23N5O4
InChI InChI=1S/C21H23N5O4/c1-2-30-20(29)15-4-6-16(7-5-15)26-18(27)14-17(19(26)28)24-10-12-25(13-11-24)21-22-8-3-9-23-21/h3-9,17H,2,10-14H2,1H3
InChIKey XIPGCMPIHSEWAP-UHFFFAOYSA-N
Molecular Weight 409.446 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1461
Solvent DMSO-d6
Source Vendor ID: NMR/12269827