CID 43188719

2803856-64-4

Structural Information

Molecular Formula
C12H17FN2O
SMILES
CC(C1=C(C=CC(=C1)F)N2CCOCC2)N
InChI
InChI=1S/C12H17FN2O/c1-9(14)11-8-10(13)2-3-12(11)15-4-6-16-7-5-15/h2-3,8-9H,4-7,14H2,1H3
InChIKey
VJANOVQGPHPKAQ-UHFFFAOYSA-N
Compound name
1-(5-fluoro-2-morpholin-4-ylphenyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.13249 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.139766 151.8
[M+Na]+ 247.121708 157.1
[M-H]- 223.125214 155.4
[M+NH4]+ 242.166313 166.6
[M+K]+ 263.095648 155.2
[M+H-H2O]+ 207.129750 142.8
[M+HCOO]- 269.130691 168.8
[M+CH3COO]- 283.146341 191.7
[M+Na-2H]- 245.107156 154.7
[M]+ 224.13194142 145.8
[M]- 224.13303858 145.8
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.