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2-[(3-hydroxy-5-methyl-1H-pyrazol-4-yl)(phenyl)methyl]malononitrile
SpectraBase Compound ID 3DU2u15XauQ
InChI InChI=1S/C14H12N4O/c1-9-12(14(19)18-17-9)13(11(7-15)8-16)10-5-3-2-4-6-10/h2-6,11,13H,1H3,(H2,17,18,19)
InChIKey PREWUOUZXDHVOV-UHFFFAOYSA-N
Mol Weight 252.28 g/mol
Molecular Formula C14H12N4O
Exact Mass 252.101111 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CRlvgot9CSq
Name 2-[(3-hydroxy-5-methyl-1H-pyrazol-4-yl)(phenyl)methyl]malononitrile
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/C14H12N4O/c1-9-12(14(19)18-17-9)13(11(7-15)8-16)10-5-3-2-4-6-10/h2-6,11,13H,1H3,(H2,17,18,19)
InChIKey PREWUOUZXDHVOV-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_312
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: NMR/8315038; Labnumber: NVN-0000094; IOH_ID: IOH-000313
Temperature 303 °C