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PYRAZOLINE
SpectraBase Compound ID DyPoK7Hvat5
InChI InChI=1S/C21H28N2O4/c1-13-5-8-20-12-27-18(25)21(20)15(10-22-23-21)3-4-16(20)19(13,2)7-6-14-9-17(24)26-11-14/h9,13,15-16H,3-8,10-12H2,1-2H3/t13-,15+,16-,19+,20-,21+/m0/s1
InChIKey KLGREVOBBSNXRT-BOKJEUAKSA-N
Mol Weight 372.47 g/mol
Molecular Formula C21H28N2O4
Exact Mass 372.204907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DCs6Tcvai3a
Name PYRAZOLINE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28N2O4
InChI InChI=1S/C21H28N2O4/c1-13-5-8-20-12-27-18(25)21(20)15(10-22-23-21)3-4-16(20)19(13,2)7-6-14-9-17(24)26-11-14/h9,13,15-16H,3-8,10-12H2,1-2H3/t13-,15+,16-,19+,20-,21+/m0/s1
InChIKey KLGREVOBBSNXRT-BOKJEUAKSA-N
Literature Reference Author F.M.HARRAZ,R.W.DOSKOTCH
Literature Reference Citation J.NAT.PROD.,53,1312(1990)
Literature Reference DOI 10.1021/np50071a027
Molecular Weight 372.464 g/mol
Solvent CDCl3
Source File Reference UWRU145