庚酸鈉(10051-45-3)紅外圖譜(IR1)
分子式:C7H13NaO2
分子量: 152.17
InChI:InChI=1S/C7H14O2.Na/c1-2-3-4-5-6-7(8)9;/h2-6H2,1H3,(H,8,9);/q;+1/p-1
InChIKey: NMTDPTPUELYEPL-UHFFFAOYSA-M
Smiles:C(CCCC)CC([O-])=O.[Na+]
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Assign. Shift(ppm)
A 2.173
B 1.544
C 1.29
D 0.873
Spectral Code: 1H NMR : 400 MHz in D2O
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ppm Int. Assign.
184.74 598 1
38.58 759 2
31.88 901 3
29.45 993 4
26.77 888 5
22.89 1000 6
14.36 932 7
Spectral Code: 13C NMR : D2O
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Spectral Code: IR : KBr disc