CID 17605468

2-(2-fluorophenoxy)aniline

Structural Information

Molecular Formula
C12H10FNO
SMILES
C1=CC=C(C(=C1)N)OC2=CC=CC=C2F
InChI
InChI=1S/C12H10FNO/c13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14/h1-8H,14H2
InChIKey
FMHXQFVNBSTBQV-UHFFFAOYSA-N
Compound name
2-(2-fluorophenoxy)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

203.07465 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.08193 140.9
[M+Na]+ 226.06387 149.5
[M-H]- 202.06737 146.3
[M+NH4]+ 221.10847 159.5
[M+K]+ 242.03781 145.7
[M+H-H2O]+ 186.07191 133.0
[M+HCOO]- 248.07285 165.6
[M+CH3COO]- 262.08850 187.2
[M+Na-2H]- 224.04932 147.4
[M]+ 203.07410 138.7
[M]- 203.07520 138.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe