西他氯銨(122-18-9)Raman光譜
分子式:C25H46ClN
分子量: 396.09
InChI:InChI=1S/C25H46N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26(2,3)24-25-21-18-17-19-22-25;/h17-19,21-22H,4-16,20,23-24H2,1-3H3;1H/q+1;/p-1
InChIKey: SXPWTBGAZSPLHA-UHFFFAOYSA-M
Smiles:C1(=CC=CC=C1)C[N+](C)(C)CCCCCCCCCCCCCCCC.[Cl-]
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Assign. Shift(ppm)
A 7.647
B 7.43 to 7.41
C 4.966
D 3.427
E 3.277
F 1.78
G 1.31
J 1.26
K 1.23
L 0.862
Spectral Code: 1H NMR : 400 MHz in CDCl3