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(±)-2,3-Dichlorobutane(2211-67-8) 1H NMR
Product Name(±)-2,3-Dichlorobutane
CAS2211-67-8
Molecular FormulaC4H8Cl2
Molecular Weight127.01
InChIInChI=1/C4H8Cl2/c1-3(5)4(2)6/h3-4H,1-2H3/t3-,4-/s3
InChIKey RMISVOPUIFJTEO-APQYWOSTNA-N
SmilesC[C@@H](Cl)[C@H](Cl)C |&1:1,3,r|
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Parameter ppm Hz
D(A) 1.527 D(B) 4.132 J(A,A') 0.0 J(A,B) 6.47 J(A,B') -0.08 J(A',B) -0.08 J(A',B') 6.47 J(B,B') 3.45 BOTHNER-BY,A.A. & NAAR-COLIN,C. J.AM.CHEM.SOC. 84, 743 (1962)Spectral Code: 1H NMR : parameter in CS2