ACETYLTHIOCHOLINE CHLORIDE(6050-81-3) IR2
Product NameACETYLTHIOCHOLINE CHLORIDE
CAS6050-81-3
Molecular FormulaC7H16ClNOS
Molecular Weight197.72
InChIInChI=1S/C7H16NOS.ClH/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1
InChIKey GZYVLKKMMDFCKR-UHFFFAOYSA-M
SmilesC([N+](C)(C)C)CSC(=O)C.[Cl-]
-
MassMS-NW-6134 S-acetylthiocholine chloride C7H16ClNOS (Mass of molecular ion: 197)
Source Temperature: 210 °C Sample Temperature: 180 °C Direct, 75 eV
14.0 3.9 15.0 8.2 26.0 1.2 27.0 3.6 28.0 2.3 29.0 1.7 30.0 7.6 35.0 1.2 36.0 9.5 38.0 3.1 41.0 1.7 42.0 13.2 43.0 11.4 44.0 3.8 45.0 9.6 50.0 8.4 52.0 2.7 56.0 2.0 57.0 2.7 58.0 100.0 59.0 14.6 60.0 13.5 61.0 1.5 71.0 3.9 72.0 2.0
KBr disc
nujol mull
