N-TETRATETRACONTANE(7098-22-8) IR1
Product NameN-TETRATETRACONTANE
CAS7098-22-8
Molecular FormulaC44H90
Molecular Weight619.19
InChIInChI=1S/C44H90/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-44H2,1-2H3
InChIKey KMXFZRSJMDYPPG-UHFFFAOYSA-N
SmilesCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
90 MHz in CDCl3
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1H NMR 89.56 MHz C44 H90 0.012 g : 0.5 ml CDCl3 tetratetracontane 
Assign. Shift(ppm)
A 1.5 B 1.26 C 0.90
Hz ppm Int.123.75 1.382 27 123.44 1.379 28 122.75 1.371 30 122.00 1.363 33 121.31 1.355 37 119.50 1.335 49 112.56 1.257 1000 104.25 1.165 34 103.75 1.159 31 102.94 1.150 29 84.38 0.943 29 84.00 0.938 31 79.81 0.892 60 78.88 0.881 47 77.88 0.870 36
KBr disc
