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6-bromo-3-butyl-7-hydroxy-8-{[4-(2-hydroxyethyl)-1-piperazinyl]methyl}-4-methylcoumarin

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6-bromo-3-butyl-7-hydroxy-8-{[4-(2-hydroxyethyl)-1-piperazinyl]methyl}-4-methylcoumarin
SpectraBase Compound ID Gxxd4c4Cp37
InChI InChI=1S/C21H29BrN2O4/c1-3-4-5-15-14(2)16-12-18(22)19(26)17(20(16)28-21(15)27)13-24-8-6-23(7-9-24)10-11-25/h12,25-26H,3-11,13H2,1-2H3
InChIKey QATJSBAUEHWAID-UHFFFAOYSA-N
Mol Weight 453.38 g/mol
Molecular Formula C21H29BrN2O4
Exact Mass 452.13107 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HHUsV8xAUuw
Name 6-BROMO-3-BUTYL-7-HYDROXY-8-{[4-(2-HYDROXYETHYL)-1-PIPERAZINYL]METHYL}-4-METHYLCOUMARIN
Source of Sample A. Cascaval, Polytechnic Institute of Iassy, Iasi, Romania
Copyright Copyright © 1991-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29BrN2O4
InChI InChI=1S/C21H29BrN2O4/c1-3-4-5-15-14(2)16-12-18(22)19(26)17(20(16)28-21(15)27)13-24-8-6-23(7-9-24)10-11-25/h12,25-26H,3-11,13H2,1-2H3
InChIKey QATJSBAUEHWAID-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 146-147C
Molecular Weight 453.39
Solvent CDCl3; Reference=TMS; Temperature 297K