Product Name4-METHYLBENZO-15-CROWN-5
CAS32702-27-5
Molecular FormulaC15H22O5
Molecular Weight282.33
InChIInChI=1S/C15H22O5/c1-13-2-3-14-15(12-13)20-11-9-18-7-5-16-4-6-17-8-10-19-14/h2-3,12H,4-11H2,1H3
InChIKey HCQGDZNYDMLVRI-UHFFFAOYSA-N
SmilesO1C2=CC=C(C)C=C2OCCOCCOCCOCC1
Assign. Shift(ppm)
A 6.767 B 6.70 C 6.69 D 4.14 to 4.09 E 3.92 to 3.87 F 3.79 to 3.72 G 2.270
ppm Int. Assign.
149.21 362 1 147.14 334 2 131.23 385 3 121.62 545 4 115.54 506 5 * 114.86 494 6 * 71.13 1000 7 8 70.74 512 9 # 70.69 634 10 # 69.86 518 11 # 69.79 613 12 # 69.64 499 13 # 69.23 497 14 # 20.92 419 15
4-METHYLBENZO-15-CROWN-5(32702-27-5) IR1 Atlas of Related Products
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