2(5 H)-THIOPHENONE(3354-32-3) Raman
Molecular FormulaC4H4OS
Molecular Weight100.14
InChIInChI=1S/C4H4OS/c5-4-2-1-3-6-4/h1-2H,3H2
InChIKey NMSLUAZZTFUUFZ-UHFFFAOYSA-N
SmilesC1CSC(=O)C=1
-

Parameter ppm Hz
D(A) 6.47
D(B) 7.84
D(C) 4.29
J(A,B) 5.9
J(A,C) 2.0
J(B,C) 2.8
HOERNFELDT,A.-B. & GRONOWITZ,S. ARK.KEMI. 21, 239 (1963)
Spectral Code: 1H NMR : parameter in cyclohexane