1,1'-二苯甲酰基二茂鐵(12180-80-2)核磁圖(13CNMR)
分子式:C24H18FeO210*
分子量: 394.24
InChI:InChI=1S/2C12H9O.Fe/c2*13-12(11-8-4-5-9-11)10-6-2-1-3-7-10;/h2*1-9H;
InChIKey: HAAYOEOQZIDZLZ-UHFFFAOYSA-N
Smiles:[C]1([CH][CH][CH][CH]1)C(=O)C1C=CC=CC=1.[C]1([CH][CH][CH][CH]1)C(=O)C1=CC=CC=C1.[Fe] |^1:0,1,2,3,4,13,14,15,16,17|
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Assign. Shift(ppm)
A 7.775
B 7.605
C 7.496
D 4.856
E 4.713
Assigned with HMQC and HMBC.
Spectral Code: 1H NMR : in DMSO-d6
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ppm Int. Assign.
197.94 98 1
139.15 201 2
131.98 506 3
128.41 1000 4 *
128.18 884 5 *
79.62 183 6
74.79 713 7 #
73.26 744 8 #
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : KBr disc