3-Butoxypropionitrile
Product Name
3-Butoxypropionitrile
CAS6959-71-3
MFC7H13NO
MW127.18
InChIInChI=1S/C7H13NO/c1-2-3-6-9-7-4-5-8/h2-4,6-7H2,1H3
InChIKeyAWVNJBFNHGQUQU-UHFFFAOYSA-N
SmilesC(#N)CCOCCCC
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Assign. Shift(ppm)
A 3.614
B 3.47
C 2.571
D 1.55
E 1.37
F 0.91
Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
118.14 323 1
71.15 910 2
65.35 881 3
31.64 990 4
19.27 1000 5
18.91 851 6
13.88 811 7
Spectral 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
3-Butoxypropionitrile(6959-71-3)Raman Atlas of Related Products