DL-谷氨酸鈣水合物(67525-74-0)紅外圖譜(IR1)
分子式:C6H10CaO8
分子量: 250.22
InChI:InChI=1S/2C3H6O4.Ca/c2*4-1-2(5)3(6)7;/h2*2,4-5H,1H2,(H,6,7);/q;;+2/p-2
InChIKey: VPWAVWZPVGDNMN-UHFFFAOYSA-L
Smiles:C(=O)(O[Ca]OC(=O)C(O)CO)C(O)CO
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Assign. Shift(ppm)
A 3.812
B *1 3.560
C *1 3.485
Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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ppm Int. Assign.
177.75 1000 1
73.55 1000 2
64.01 975 3
Spectral Code: 13C NMR : in DMSO-d6
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Spectral Code: IR : nujol mull