5-氟噻吩-2甲醛
产品名称
5-氟噻吩-2甲醛
CAS号29669-49-6
分子式C5H3FOS
分子量130.14
InChIInChI=1S/C5H3FOS/c6-5-2-1-4(3-7)8-5/h1-3H
InChIKeyKURANAVGCJMDFR-UHFFFAOYSA-N
SmilesC1(C=O)SC(F)=CC=1
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Parameter ppm Hz
D(A) 6.59
D(B) 7.48
D(C) 9.69
D(X) 45.73
J(A,B) 4.25
J(A,C) 0.21
J(A,X) 1.17
J(B,C) -0.15
J(B,X) 3.66
J(C,X) 4.20
RODMAR,S. ET AL. ACTA CHEM.SCAND. 25, 3309 (1971)
F-19 REFERENCE:HEXAFLUOROBENZENE.
Spectral Code: 1H NMR : parameter in cyclohexane