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4-CHLOROPHENYLACETYLCHOLINE

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4-CHLOROPHENYLACETYLCHOLINE
SpectraBase Compound ID A2nbMnNpmmm
InChI InChI=1S/C13H19ClNO2.HI/c1-15(2,3)8-9-17-13(16)10-11-4-6-12(14)7-5-11;/h4-7H,8-10H2,1-3H3;1H/q+1;/p-1
InChIKey LRDNACOUSIZGBH-UHFFFAOYSA-M
Mol Weight 383.66 g/mol
Molecular Formula C13H19ClINO2
Exact Mass 383.014902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F9rZP8OVWJS
Name 4-CHLOROPHENYLACETYLCHOLINE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H19ClINO2
InChI InChI=1S/C13H19ClNO2.HI/c1-15(2,3)8-9-17-13(16)10-11-4-6-12(14)7-5-11;/h4-7H,8-10H2,1-3H3;1H/q+1;/p-1
InChIKey LRDNACOUSIZGBH-UHFFFAOYSA-M
Literature Reference Author B.A.BOZSO,R.A.FLUCK,R.A.JAMETON,P.A.LEBER,J.G.VARNES
Literature Reference Citation PHYTOCHEM.,40,1027(1995)
Literature Reference DOI 10.1016/0031-9422(95)00460-O
Molecular Weight 383.657 g/mol
Solvent DMSO-D6
Source File Reference UWMS2731