CID 121552282

3-[1-methyl-4-(trifluoromethyl)-1h-imidazol-2-yl]piperidine

Structural Information

Molecular Formula
C10H14F3N3
SMILES
CN1C=C(N=C1C2CCCNC2)C(F)(F)F
InChI
InChI=1S/C10H14F3N3/c1-16-6-8(10(11,12)13)15-9(16)7-3-2-4-14-5-7/h6-7,14H,2-5H2,1H3
InChIKey
ZPUMPEAGLZCEBQ-UHFFFAOYSA-N
Compound name
3-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.11398 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.12126 151.1
[M+Na]+ 256.10320 158.4
[M-H]- 232.10670 148.2
[M+NH4]+ 251.14780 165.9
[M+K]+ 272.07714 154.1
[M+H-H2O]+ 216.11124 140.4
[M+HCOO]- 278.11218 162.9
[M+CH3COO]- 292.12783 186.7
[M+Na-2H]- 254.08865 152.4
[M]+ 233.11343 141.7
[M]- 233.11453 141.7
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.