CID 137966031

2230804-19-8

Structural Information

Molecular Formula
C7H10F3N3
SMILES
CNCC1=NC=C(N1C)C(F)(F)F
InChI
InChI=1S/C7H10F3N3/c1-11-4-6-12-3-5(13(6)2)7(8,9)10/h3,11H,4H2,1-2H3
InChIKey
WYIUUIZVIOJAHZ-UHFFFAOYSA-N
Compound name
N-methyl-1-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.08269 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.08997 136.9
[M+Na]+ 216.07191 146.7
[M-H]- 192.07541 134.6
[M+NH4]+ 211.11651 155.8
[M+K]+ 232.04585 144.4
[M+H-H2O]+ 176.07995 127.8
[M+HCOO]- 238.08089 156.5
[M+CH3COO]- 252.09654 185.8
[M+Na-2H]- 214.05736 141.7
[M]+ 193.08214 133.7
[M]- 193.08324 133.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.