CID 28581820

2-fluoro-n-[2-(morpholin-4-yl)ethyl]aniline

Structural Information

Molecular Formula
C12H17FN2O
SMILES
C1COCCN1CCNC2=CC=CC=C2F
InChI
InChI=1S/C12H17FN2O/c13-11-3-1-2-4-12(11)14-5-6-15-7-9-16-10-8-15/h1-4,14H,5-10H2
InChIKey
XTUKLPCGSNKBGD-UHFFFAOYSA-N
Compound name
2-fluoro-N-(2-morpholin-4-ylethyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.13249 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.13977 150.2
[M+Na]+ 247.12171 154.8
[M-H]- 223.12521 153.7
[M+NH4]+ 242.16631 165.0
[M+K]+ 263.09565 152.7
[M+H-H2O]+ 207.12975 140.8
[M+HCOO]- 269.13069 168.9
[M+CH3COO]- 283.14634 190.3
[M+Na-2H]- 245.10716 156.2
[M]+ 224.13194 145.4
[M]- 224.13304 145.4
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.