Crotonic acid(3724-65-0) 13C NMR
Product NameCrotonic acid
CAS3724-65-0
Molecular FormulaC4H6O2
Molecular Weight86.09
InChIInChI=1S/C4H6O2/c1-2-3-4(5)6/h2-3H,1H3,(H,5,6)
InChIKey LDHQCZJRKDOVOX-UHFFFAOYSA-N
SmilesC(O)(=O)C=CC
-
MassMS-NW-0599 crotonic acid C4H6O2 (Mass of molecular ion: 86)
Source Temperature: 270 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 4.4 18.0 2.6 25.0 1.1 26.0 4.9 27.0 12.6 28.0 3.6 29.0 4.6 30.0 1.3 31.0 2.1 36.0 1.1 37.0 7.4 38.0 13.2 39.0 81.2 40.0 25.9 41.0 89.7 42.0 9.0 43.0 7.0 44.0 2.4 45.0 19.6 53.0 2.4 55.0 2.1 57.0 5.5 58.0 1.8 60.0 2.0 68.0 39.3 69.0 40.9 70.0 1.8 71.0 13.2 85.0 3.3 86.0 100.0 87.0 4.8
in CDCl3
CCl4 solution
KBr disc
nujol mull
4880 A,200 M,powder
