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1-(2-HYDROXY-5-METHYLPHENYL)-3-(3,5-DIMETHYL-5-IODOPYRAZOL-1-YL)-PROPAN-1-ONE
SpectraBase Compound ID E4q1SeiqpDB
InChI InChI=1S/C15H17IN2O2/c1-9-4-5-13(19)12(8-9)14(20)6-7-18-11(3)15(16)10(2)17-18/h4-5,8,19H,6-7H2,1-3H3
InChIKey VRCXPZWJOWHMJA-UHFFFAOYSA-N
Mol Weight 384.22 g/mol
Molecular Formula C15H17IN2O2
Exact Mass 384.033473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HRpsUx7HwMk
Name 1-(2-HYDROXY-5-METHYLPHENYL)-3-(3,5-DIMETHYL-5-IODOPYRAZOL-1-YL)-PROPAN-1-ONE
Compound Number 2G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H17IN2O2
InChI InChI=1S/C15H17IN2O2/c1-9-4-5-13(19)12(8-9)14(20)6-7-18-11(3)15(16)10(2)17-18/h4-5,8,19H,6-7H2,1-3H3
InChIKey VRCXPZWJOWHMJA-UHFFFAOYSA-N
Literature Reference Author G.ROMAN,E.COMANITA,B.COMANITA
Literature Reference Citation CHEM.HET.COMP.,38,1072(2002)
Literature Reference DOI 10.1023/a:1021201214319
Molecular Weight 384.217 g/mol
Solvent CDCl3
Source File Reference UWMZ10809