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2-(methyl{4-nitro-7-[4-(2-pyrimidinyl)-1-piperazinyl]-2,1,3-benzoxadiazol-5-yl}amino)ethanol
SpectraBase Compound ID AvDcIKkCm7U
InChI InChI=1S/C17H20N8O4/c1-22(9-10-26)13-11-12(14-15(21-29-20-14)16(13)25(27)28)23-5-7-24(8-6-23)17-18-3-2-4-19-17/h2-4,11,26H,5-10H2,1H3
InChIKey RLVOAWWXKGYTSZ-UHFFFAOYSA-N
Mol Weight 400.4 g/mol
Molecular Formula C17H20N8O4
Exact Mass 400.160751 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9NjvvGl1nGY
Name 2-(methyl{4-nitro-7-[4-(2-pyrimidinyl)-1-piperazinyl]-2,1,3-benzoxadiazol-5-yl}amino)ethanol
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.160751152 u
Formula C17H20N8O4
InChI InChI=1S/C17H20N8O4/c1-22(9-10-26)13-11-12(14-15(21-29-20-14)16(13)25(27)28)23-5-7-24(8-6-23)17-18-3-2-4-19-17/h2-4,11,26H,5-10H2,1H3
InChIKey RLVOAWWXKGYTSZ-UHFFFAOYSA-N
Molecular Weight 400.399 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1765
Solvent DMSO-d6
Source Vendor ID: NMR/12278365