3-UNDECYNE(60212-30-8) IR1
Product Name3-UNDECYNE
CAS60212-30-8
Molecular FormulaC11H20
Molecular Weight152.28
InChIInChI=1S/C11H20/c1-3-5-7-9-11-10-8-6-4-2/h3-5,7,9-11H2,1-2H3
InChIKey DPWGJNPCPLQVKQ-UHFFFAOYSA-N
SmilesCCC#CCCCCCCC
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Assign. Shift(ppm)
A 2.16 B 2.13 C 1.30 D 1.12 E 0.90Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
81.58 235 1 79.60 345 2 31.91 520 3 29.32 540 4 * 28.97 1000 5 * 22.75 465 6 18.84 420 7 14.46 405 8 14.11 425 9 12.52 370 10Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : liquid film
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Spectral Code: Raman : 4880 A,200 M,liquid
