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3-CYANO-1-METHYL-5-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID 7bw7Ggv9biu
InChI InChI=1S/C14H13N3O2/c1-3-19-14(18)12-11(9-15)16-17(2)13(12)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3
InChIKey RIRHGAGSMLUNII-UHFFFAOYSA-N
Mol Weight 255.28 g/mol
Molecular Formula C14H13N3O2
Exact Mass 255.100777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DPBaWsdNkhH
Name 3-CYANO-1-METHYL-5-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC-ACID-ETHYLESTER
Compound Number 14F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H13N3O2
InChI InChI=1S/C14H13N3O2/c1-3-19-14(18)12-11(9-15)16-17(2)13(12)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3
InChIKey RIRHGAGSMLUNII-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 255.276 g/mol
Solvent Unknown
Source File Reference WANG1650