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3-{4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2,2-dimethyl-4-oxobutyl}-2H-1,2,4-benzothiadiazine 1,1-dioxide
SpectraBase Compound ID LRDy4ram8HG
InChI InChI=1S/C25H32N4O3S/c1-18-8-7-10-21(19(18)2)28-12-14-29(15-13-28)24(30)17-25(3,4)16-23-26-20-9-5-6-11-22(20)33(31,32)27-23/h5-11H,12-17H2,1-4H3,(H,26,27)
InChIKey BXFPTYJZNLTBNS-UHFFFAOYSA-N
Mol Weight 468.6 g/mol
Molecular Formula C25H32N4O3S
Exact Mass 468.219512 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4CnLP54bn49
Name 3-{4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2,2-dimethyl-4-oxobutyl}-2H-1,2,4-benzothiadiazine 1,1-dioxide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 468.219512077 u
Formula C25H32N4O3S
InChI InChI=1S/C25H32N4O3S/c1-18-8-7-10-21(19(18)2)28-12-14-29(15-13-28)24(30)17-25(3,4)16-23-26-20-9-5-6-11-22(20)33(31,32)27-23/h5-11H,12-17H2,1-4H3,(H,26,27)
InChIKey BXFPTYJZNLTBNS-UHFFFAOYSA-N
Molecular Weight 468.616 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7098
Solvent DMSO-d6
Source Vendor ID: NMR/12329630