ACETYLCHOLINE IODIDE(2260-50-6) IR1
Product NameACETYLCHOLINE IODIDE
CAS2260-50-6
Molecular FormulaC7H16INO2
Molecular Weight273.11
InChIInChI=1S/C7H16NO2.HI/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1
InChIKey SMBBQHHYSLHDHF-UHFFFAOYSA-M
Smiles[N+](C)(C)(C)CCOC(=O)C.[I-]
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Assign. Shift(ppm)
A 4.44 B 3.699 C 3.167 D 2.074Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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ppm Int. Assign.
169.67 490 1 63.90 195 1) 2 63.75 252 1) 2 63.61 184 1) 2 57.57 1000 3 53.20 539 1) 4 53.04 726 1) 4 52.87 571 1) 4 20.65 949 5 1) SPLIT BY N-14Spectral Code: 13C NMR : in DMSO-d6
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Spectral Code: IR : KBr disc
