CID 43122235

[4-(2,6-dimethylmorpholin-4-yl)-3-fluorophenyl]methanamine

Structural Information

Molecular Formula
C13H19FN2O
SMILES
CC1CN(CC(O1)C)C2=C(C=C(C=C2)CN)F
InChI
InChI=1S/C13H19FN2O/c1-9-7-16(8-10(2)17-9)13-4-3-11(6-15)5-12(13)14/h3-5,9-10H,6-8,15H2,1-2H3
InChIKey
RQXUTJPPGWZYLD-UHFFFAOYSA-N
Compound name
[4-(2,6-dimethylmorpholin-4-yl)-3-fluorophenyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

238.14815 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.15543 157.2
[M+Na]+ 261.13737 169.2
[M+NH4]+ 256.18197 164.8
[M+K]+ 277.11131 162.7
[M-H]- 237.14087 161.4
[M+Na-2H]- 259.12282 162.4
[M]+ 238.14760 160.0
[M]- 238.14870 160.0
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

patents stripe