N-PENTADECANONITRILE(18300-91-9) IR1
Product NameN-PENTADECANONITRILE
CAS18300-91-9
Molecular FormulaC15H29N
Molecular Weight223.4
InChIInChI=1S/C15H29N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h2-14H2,1H3
InChIKey KRKQHNVYOWTEQO-UHFFFAOYSA-N
SmilesC(#N)CCCCCCCCCCCCCC
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Assign. Shift(ppm)
A 2.32 B 1.65 C 1.26 D 0.89Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
119.76 149 1 31.99 333 2 29.71 1000 3 * 29.58 398 4 * 29.41 517 5 * 28.84 368 6 # 28.74 343 7 # 25.48 299 8 22.75 303 9 17.14 279 10 14.13 259 11Spectral 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
