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ethanediamide, N~1~-[1,1-bis(hydroxymethyl)propyl]-N~2~-[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]-
SpectraBase Compound ID 4pqqV98Akv0
InChI InChI=1S/C16H21N5O4/c1-2-16(8-22,9-23)20-15(25)14(24)19-13-5-3-12(4-6-13)7-21-11-17-10-18-21/h3-6,10-11,22-23H,2,7-9H2,1H3,(H,19,24)(H,20,25)
InChIKey MEPZNSNVEYFISG-UHFFFAOYSA-N
Mol Weight 347.38 g/mol
Molecular Formula C16H21N5O4
Exact Mass 347.159354 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DveIhUxVvP7
Name ethanediamide, N~1~-[1,1-bis(hydroxymethyl)propyl]-N~2~-[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H21N5O4/c1-2-16(8-22,9-23)20-15(25)14(24)19-13-5-3-12(4-6-13)7-21-11-17-10-18-21/h3-6,10-11,22-23H,2,7-9H2,1H3,(H,19,24)(H,20,25)
InChIKey MEPZNSNVEYFISG-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_10756
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F38314; Labnumber: NNA-V-30490
Temperature 315 °C