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1,4-piperazinedipentanoic acid, gamma~1~,gamma~1~,gamma~4~,gamma~4~-tetranitro-, dimethyl ester

View entire compound with spectra: 1 NMR

1,4-piperazinedipentanoic acid, gamma~1~,gamma~1~,gamma~4~,gamma~4~-tetranitro-, dimethyl ester
SpectraBase Compound ID 58PEMezTulS
InChI InChI=1S/C16H26N6O12/c1-33-13(23)3-5-15(19(25)26,20(27)28)11-17-7-9-18(10-8-17)12-16(21(29)30,22(31)32)6-4-14(24)34-2/h3-12H2,1-2H3
InChIKey ZALDJNRBHGAPFX-UHFFFAOYSA-N
Mol Weight 494.41 g/mol
Molecular Formula C16H26N6O12
Exact Mass 494.16087 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Eiq5pccWW6D
Name 1,4-piperazinedipentanoic acid, gamma~1~,gamma~1~,gamma~4~,gamma~4~-tetranitro-, dimethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 494.160870289 u
Formula C16H26N6O12
InChI InChI=1S/C16H26N6O12/c1-33-13(23)3-5-15(19(25)26,20(27)28)11-17-7-9-18(10-8-17)12-16(21(29)30,22(31)32)6-4-14(24)34-2/h3-12H2,1-2H3
InChIKey ZALDJNRBHGAPFX-UHFFFAOYSA-N
Molecular Weight 494.414 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4319
Solvent DMSO-d6
Source Vendor ID: NMR/9311948; Lab Info:Godovikova,L31