CID 211771

N-(alpha,alpha,alpha-trifluoro-m-tolyl)nicotinamidine

Structural Information

Molecular Formula
C13H10F3N3
SMILES
C1=CC(=CC(=C1)N=C(C2=CN=CC=C2)N)C(F)(F)F
InChI
InChI=1S/C13H10F3N3/c14-13(15,16)10-4-1-5-11(7-10)19-12(17)9-3-2-6-18-8-9/h1-8H,(H2,17,19)
InChIKey
OWXPTUNZVBFFRK-UHFFFAOYSA-N
Compound name
N'-[3-(trifluoromethyl)phenyl]pyridine-3-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

265.08267 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.08995 156.2
[M+Na]+ 288.07189 165.8
[M+NH4]+ 283.11649 161.7
[M+K]+ 304.04583 160.1
[M-H]- 264.07539 156.1
[M+Na-2H]- 286.05734 163.4
[M]+ 265.08212 157.2
[M]- 265.08322 157.2
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

patents stripe