1,1-环丁基二甲酸(5445-51-2)红外图谱(IR1)
InChI:InChI=1S/C6H8O4/c7-4(8)6(5(9)10)2-1-3-6/h1-3H2,(H,7,8)(H,9,10)
InChIKey: CCQPAEQGAVNNIA-UHFFFAOYSA-N
Smiles:C1(C(O)=O)(C(O)=O)CCC1
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ppm Int. Assign.
172.80 760 1
52.17 421 2
28.17 1000 3
15.47 520 4
Spectral Code: 13C NMR : in DMSO-d6
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Spectral Code: IR : KBr disc