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4-(4H-1,2,4-triazol-4-yl)-4-azatricyclo[5.2.2.0~2,6~]undec-8-ene-3,5-dione

View entire compound with spectra: 1 NMR

4-(4H-1,2,4-triazol-4-yl)-4-azatricyclo[5.2.2.0~2,6~]undec-8-ene-3,5-dione
SpectraBase Compound ID 8FfDsx7FA3M
InChI InChI=1S/C12H12N4O2/c17-11-9-7-1-2-8(4-3-7)10(9)12(18)16(11)15-5-13-14-6-15/h1-2,5-10H,3-4H2
InChIKey VWCVMBQSNQJCMW-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C12H12N4O2
Exact Mass 244.096026 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ChwrmJaNGN2
Name 4-(4H-1,2,4-triazol-4-yl)-4-azatricyclo[5.2.2.0~2,6~]undec-8-ene-3,5-dione
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/C12H12N4O2/c17-11-9-7-1-2-8(4-3-7)10(9)12(18)16(11)15-5-13-14-6-15/h1-2,5-10H,3-4H2
InChIKey VWCVMBQSNQJCMW-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_4204
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: 112274; Labnumber: AMIR-4738; VK_ID: VK-004205
Temperature 308 °C