CID 2990685

N-(2-methoxyethyl)-5-(trifluoromethyl)pyridin-2-amine

Structural Information

Molecular Formula
C9H11F3N2O
SMILES
COCCNC1=NC=C(C=C1)C(F)(F)F
InChI
InChI=1S/C9H11F3N2O/c1-15-5-4-13-8-3-2-7(6-14-8)9(10,11)12/h2-3,6H,4-5H2,1H3,(H,13,14)
InChIKey
ARTVNXIPAGVLJJ-UHFFFAOYSA-N
Compound name
N-(2-methoxyethyl)-5-(trifluoromethyl)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.08235 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.089626 144.0
[M+Na]+ 243.071568 152.1
[M-H]- 219.075074 142.4
[M+NH4]+ 238.116173 160.9
[M+K]+ 259.045508 149.5
[M+H-H2O]+ 203.079610 134.6
[M+HCOO]- 265.080551 163.7
[M+CH3COO]- 279.096201 189.9
[M+Na-2H]- 241.057016 150.7
[M]+ 220.08180142 141.3
[M]- 220.08289858 141.3
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.