For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-[2-(5-Amino-1H-1,2,4-triazol-3-yl)ethyl]-1H-isoindole-1,3(2H)-dione

View entire compound with spectra: 2 NMR, and 1 MS (GC)

2-[2-(5-Amino-1H-1,2,4-triazol-3-yl)ethyl]-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID 1fpR0UCbP9Q
InChI InChI=1S/C12H11N5O2/c13-12-14-9(15-16-12)5-6-17-10(18)7-3-1-2-4-8(7)11(17)19/h1-4H,5-6H2,(H3,13,14,15,16)
InChIKey KSDXFQADPHAOLF-UHFFFAOYSA-N
Mol Weight 257.25 g/mol
Molecular Formula C12H11N5O2
Exact Mass 257.091275 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Em0qCxLL1tJ
Name 1H-isoindole-1,3(2H)-dione, 2-[2-(5-amino-1H-1,2,4-triazol-3-yl)ethyl]-
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/C12H11N5O2/c13-12-14-9(15-16-12)5-6-17-10(18)7-3-1-2-4-8(7)11(17)19/h1-4H,5-6H2,(H3,13,14,15,16)
InChIKey KSDXFQADPHAOLF-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_8428
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: ZERO/005189; IOH_ID: IOH-015433