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3-CYANO-1H-PYRAZOLE-4-CARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID 4zG1aieQdbb
InChI InChI=1S/C7H7N3O2/c1-2-12-7(11)5-4-9-10-6(5)3-8/h4H,2H2,1H3,(H,9,10)
InChIKey YIFOMNFBIJFEFH-UHFFFAOYSA-N
Mol Weight 165.15 g/mol
Molecular Formula C7H7N3O2
Exact Mass 165.053826 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EqynpbA69eq
Name 3-CYANO-1H-PYRAZOLE-4-CARBOXYLIC-ACID-ETHYLESTER
Compound Number 17B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H7N3O2
InChI InChI=1S/C7H7N3O2/c1-2-12-7(11)5-4-9-10-6(5)3-8/h4H,2H2,1H3,(H,9,10)
InChIKey YIFOMNFBIJFEFH-UHFFFAOYSA-N
Literature Reference Author R.L.ROBEY,C.A.ALT,E.E.VANMETER
Literature Reference Citation J.HETCYCL.CHEM.,34,413(1997)
Literature Reference DOI 10.1002/jhet.5570340210
Molecular Weight 165.151 g/mol
Solvent Unknown
Source File Reference WANG1652