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Acetylcholine

View entire compound with spectra: 7 NMR, 3 FTIR, 1 Raman, and 2 MS (GC)

Acetylcholine
SpectraBase Compound ID 9qnTC3x7NXk
InChI InChI=1S/C7H16NO2.ClH/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1
InChIKey JUGOREOARAHOCO-UHFFFAOYSA-M
Mol Weight 181.66 g/mol
Molecular Formula C7H16ClNO2
Exact Mass 181.086956 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KD2w1FfVjUK
Name Acetylcholine chloride
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H16ClNO2
InChI InChI=1S/C7H16NO2.ClH/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1
InChIKey JUGOREOARAHOCO-UHFFFAOYSA-M
Instrument Name Varian A-60
Sadtler NMR Number 6819M
Solvent D2O
Synonyms CHOLINE CHLORIDE, ACETATE CHOLINE, ACETATE CHOLINE, ACETYL-, AMMONIUM CHLORIDE, /2-HYDROXY- ETHYL/TRIMETHYL-, ACETATE