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Acetylthiocholine iodide

View entire compound with spectra: 5 NMR, 5 FTIR, and 1 Raman

Acetylthiocholine iodide
SpectraBase Compound ID 2NmJhgJX1BP
InChI InChI=1S/C7H16NOS.HI/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1
InChIKey NTBLZMAMTZXLBP-UHFFFAOYSA-M
Mol Weight 289.17547 g/mol
Molecular Formula C7H16INOS
Exact Mass 288.99973 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7RcKIQvfsS7
Name Acetylthiocholine iodide
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 1866-15-5
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H16INOS
InChI InChI=1S/C7H16NOS.HI/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1
InChIKey NTBLZMAMTZXLBP-UHFFFAOYSA-M
Instrument Name BRUKER AC-300
Melting Point 205-208C
Solvent D2O; Reference=TSP; Temperature 297K
Synonyms (2-Mercaptoethyl)trimethylammonium iodide, acetate