CID 11401677

1,3-di-tert-butylimidazolium tetrafluoroborate

Structural Information

Molecular Formula
C11H21N2
SMILES
CC(C)(C)N1C=C[N+](=C1)C(C)(C)C
InChI
InChI=1S/C11H21N2/c1-10(2,3)12-7-8-13(9-12)11(4,5)6/h7-9H,1-6H3/q+1
InChIKey
MXBZSBSKUMTJDH-UHFFFAOYSA-N
Compound name
1,3-ditert-butylimidazol-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

288
Patents

181.17047 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.17775 143.5
[M+Na]+ 204.15969 152.2
[M-H]- 180.16319 145.4
[M+NH4]+ 199.20429 163.4
[M+K]+ 220.13363 145.6
[M+H-H2O]+ 164.16773 140.7
[M+HCOO]- 226.16867 162.3
[M+CH3COO]- 240.18432 177.0
[M+Na-2H]- 202.14514 152.1
[M]+ 181.16992 143.9
[M]- 181.17102 143.9
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