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]+ 221.08963 144.0
[M+Na]+ 243.07157 152.1
[M-H]- 219.07507 142.4
[M+NH4]+ 238.11617 160.9
[M+K]+ 259.04551 149.5
[M+H-H2O]+ 203.07961 134.6
[M+HCOO]- 265.08055 163.7
[M+CH3COO]- 279.09620 189.9
[M+Na-2H]- 241.05702 150.7
[M]+ 220.08180 141.3
[M]- 220.08290 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.