BENZYLTRIETHYLAMMONIUM IODIDE(5400-94-2) 13C NMR
Molecular FormulaC13H22IN
Molecular Weight319.22
InChIInChI=1S/C13H22N.HI/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13;/h7-11H,4-6,12H2,1-3H3;1H/q+1;/p-1
InChIKey JWLJBISFJGEYMT-UHFFFAOYSA-M
Smiles[N+](CC)(CC)(CC)CC1=CC=CC=C1.[I-]
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Assign. Shift(ppm)
A 7.72 to 7.26
B 4.700
C 3.419
D 1.468
Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
132.56 710 1
130.74 329 2
129.42 729 3
126.93 401 4
61.34 174 5
53.24 527 6
8.98 1000 7
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : KBr disc