CID 39869111

[4-(morpholin-4-yl)-2-(trifluoromethyl)phenyl]methanamine

Structural Information

Molecular Formula
C12H15F3N2O
SMILES
C1COCCN1C2=CC(=C(C=C2)CN)C(F)(F)F
InChI
InChI=1S/C12H15F3N2O/c13-12(14,15)11-7-10(2-1-9(11)8-16)17-3-5-18-6-4-17/h1-2,7H,3-6,8,16H2
InChIKey
COWJRZUKFFPOFA-UHFFFAOYSA-N
Compound name
[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.11365 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.12093 161.4
[M+Na]+ 283.10287 169.8
[M+NH4]+ 278.14747 166.7
[M+K]+ 299.07681 164.7
[M-H]- 259.10637 161.3
[M+Na-2H]- 281.08832 165.1
[M]+ 260.11310 162.2
[M]- 260.11420 162.2
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

No patent data available for this compound.