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(+)-(1R,2R)-2-ISOPROPYL-1-(4-CHLOROPHENYL)-BUT-3-YN-1-OL
SpectraBase Compound ID FcVzIgdTidc
InChI InChI=1S/C13H15ClO/c1-4-12(9(2)3)13(15)10-5-7-11(14)8-6-10/h1,5-9,12-13,15H,2-3H3/t12-,13+/m1/s1
InChIKey VOWNQOXHAZGODG-OLZOCXBDSA-N
Mol Weight 222.71 g/mol
Molecular Formula C13H15ClO
Exact Mass 222.081143 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7gimmWzSvDM
Name (+)-(1R,2R)-2-ISOPROPYL-1-(4-CHLOROPHENYL)-BUT-3-YN-1-OL
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H15ClO
InChI InChI=1S/C13H15ClO/c1-4-12(9(2)3)13(15)10-5-7-11(14)8-6-10/h1,5-9,12-13,15H,2-3H3/t12-,13+/m1/s1
InChIKey VOWNQOXHAZGODG-OLZOCXBDSA-N
Literature Reference Author L.R.REDDY,H.J.GAIS,C.W.WOO,G.RAABE
Literature Reference Citation J.AM.CHEM.SOC.,124,10427(2002)
Literature Reference DOI 10.1021/ja020570u
Molecular Weight 222.714 g/mol
Sample ID 49062
Solvent CDCl3