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1-piperazineacetamide, 4-(6-nitro-2-benzothiazolyl)-N-(2,4,6-trimethylphenyl)-
SpectraBase Compound ID LApAFo1fbtd
InChI InChI=1S/C22H25N5O3S/c1-14-10-15(2)21(16(3)11-14)24-20(28)13-25-6-8-26(9-7-25)22-23-18-5-4-17(27(29)30)12-19(18)31-22/h4-5,10-12H,6-9,13H2,1-3H3,(H,24,28)
InChIKey LQIJVZWWBNCICL-UHFFFAOYSA-N
Mol Weight 439.53 g/mol
Molecular Formula C22H25N5O3S
Exact Mass 439.167811 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KZrMXEoUZjt
Name 1-piperazineacetamide, 4-(6-nitro-2-benzothiazolyl)-N-(2,4,6-trimethylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 439.167810856 u
Formula C22H25N5O3S
InChI InChI=1S/C22H25N5O3S/c1-14-10-15(2)21(16(3)11-14)24-20(28)13-25-6-8-26(9-7-25)22-23-18-5-4-17(27(29)30)12-19(18)31-22/h4-5,10-12H,6-9,13H2,1-3H3,(H,24,28)
InChIKey LQIJVZWWBNCICL-UHFFFAOYSA-N
Molecular Weight 439.534 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4709
Solvent DMSO-d6
Source Vendor ID: NMR/9273204; Lab Info: LP; Lab Number: LP-0690329
Temperature 29.85 °C