5-UNDECANOL(37493-70-2) IR1
Product Name5-UNDECANOL
CAS37493-70-2
Molecular FormulaC11H24O
Molecular Weight172.31
InChIInChI=1S/C11H24O/c1-3-5-7-8-10-11(12)9-6-4-2/h11-12H,3-10H2,1-2H3
InChIKey PCFOZHPCKQPZCN-UHFFFAOYSA-N
SmilesCCCCC(O)CCCCCC
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Assign. Shift(ppm)
A 3.58 B 1.60 C 1.45 to 1.34 D 1.34 to 1.26 E 0.91 F 0.89Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
71.97 511 1 37.63 622 2 * 37.31 578 3 * 32.02 478 4 29.56 628 5 28.01 594 6 25.78 611 7 22.92 478 8 # 22.76 494 9 # 14.14 1000 10 11Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : liquid film
