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1-[5-methyl-7-(3-nitrophenyl)-4,7-dihydrotetraazolo[1,5-a]pyrimidin-6-yl]ethanone
SpectraBase Compound ID 4DtyhVRKlfO
InChI InChI=1S/C13H12N6O3/c1-7-11(8(2)20)12(18-13(14-7)15-16-17-18)9-4-3-5-10(6-9)19(21)22/h3-6,12H,1-2H3,(H,14,15,17)
InChIKey SMDRTJMQOWDRMV-UHFFFAOYSA-N
Mol Weight 300.28 g/mol
Molecular Formula C13H12N6O3
Exact Mass 300.097088 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1wqacjq0PUY
Name 1-[5-methyl-7-(3-nitrophenyl)-4,7-dihydrotetraazolo[1,5-a]pyrimidin-6-yl]ethanone
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/C13H12N6O3/c1-7-11(8(2)20)12(18-13(14-7)15-16-17-18)9-4-3-5-10(6-9)19(21)22/h3-6,12H,1-2H3,(H,14,15,17)
InChIKey SMDRTJMQOWDRMV-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_7576
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: 9686186; UBI_ID: UBI-007579
Temperature 308 °C