CID 2775941

1,3-didecyl-2-methylimidazolium chloride

Structural Information

Molecular Formula
C24H47N2
SMILES
CCCCCCCCCCN1C=C[N+](=C1C)CCCCCCCCCC
InChI
InChI=1S/C24H47N2/c1-4-6-8-10-12-14-16-18-20-25-22-23-26(24(25)3)21-19-17-15-13-11-9-7-5-2/h22-23H,4-21H2,1-3H3/q+1
InChIKey
CCEYVAPCYYFRMO-UHFFFAOYSA-N
Compound name
1,3-didecyl-2-methylimidazol-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

346
Patents

363.37393 Da
Monoisotopic Mass

9.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.38121 203.6
[M+Na]+ 386.36315 206.4
[M-H]- 362.36665 202.3
[M+NH4]+ 381.40775 215.8
[M+K]+ 402.33709 195.4
[M+H-H2O]+ 346.37119 196.6
[M+HCOO]- 408.37213 220.9
[M+CH3COO]- 422.38778 217.6
[M+Na-2H]- 384.34860 202.3
[M]+ 363.37338 210.1
[M]- 363.37448 210.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe