CID 129319038

2-(1-(trifluoromethyl)cyclopropyl)pyridin-3-amine

Structural Information

Molecular Formula
C9H9F3N2
SMILES
C1CC1(C2=C(C=CC=N2)N)C(F)(F)F
InChI
InChI=1S/C9H9F3N2/c10-9(11,12)8(3-4-8)7-6(13)2-1-5-14-7/h1-2,5H,3-4,13H2
InChIKey
WYPNNYVURSDQNC-UHFFFAOYSA-N
Compound name
2-[1-(trifluoromethyl)cyclopropyl]pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.07178 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.07906 136.3
[M+Na]+ 225.06100 146.9
[M-H]- 201.06450 138.8
[M+NH4]+ 220.10560 150.8
[M+K]+ 241.03494 143.3
[M+H-H2O]+ 185.06904 127.7
[M+HCOO]- 247.06998 155.7
[M+CH3COO]- 261.08563 188.3
[M+Na-2H]- 223.04645 143.7
[M]+ 202.07123 133.0
[M]- 202.07233 133.0
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.