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1(2H)-phthalazinone, 4-(3,4-dimethylphenyl)-2-[5-[4-(2-hydroxyethyl)-1-piperazinyl]-2-nitrophenyl]-
SpectraBase Compound ID 6eAXUtsw3kM
InChI InChI=1S/C28H29N5O4/c1-19-7-8-21(17-20(19)2)27-23-5-3-4-6-24(23)28(35)32(29-27)26-18-22(9-10-25(26)33(36)37)31-13-11-30(12-14-31)15-16-34/h3-10,17-18,34H,11-16H2,1-2H3
InChIKey WCPONQZHYSLMOS-UHFFFAOYSA-N
Mol Weight 499.57 g/mol
Molecular Formula C28H29N5O4
Exact Mass 499.221954 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ArKjfNj4lG2
Name 1(2H)-phthalazinone, 4-(3,4-dimethylphenyl)-2-[5-[4-(2-hydroxyethyl)-1-piperazinyl]-2-nitrophenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 499.221954430 u
Formula C28H29N5O4
InChI InChI=1S/C28H29N5O4/c1-19-7-8-21(17-20(19)2)27-23-5-3-4-6-24(23)28(35)32(29-27)26-18-22(9-10-25(26)33(36)37)31-13-11-30(12-14-31)15-16-34/h3-10,17-18,34H,11-16H2,1-2H3
InChIKey WCPONQZHYSLMOS-UHFFFAOYSA-N
Molecular Weight 499.571 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4597
Solvent DMSO-d6
Source Vendor ID: NMR/9290327; Lab Info: LP; Lab Number: LP-KV00977
Temperature 29.85 °C