CID 459253

2-fluoro-6-methoxyaniline

Structural Information

Molecular Formula
C7H8FNO
SMILES
COC1=C(C(=CC=C1)F)N
InChI
InChI=1S/C7H8FNO/c1-10-6-4-2-3-5(8)7(6)9/h2-4H,9H2,1H3
InChIKey
VHHKZASLPJMWJI-UHFFFAOYSA-N
Compound name
2-fluoro-6-methoxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

357
Patents

141.05899 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.066266 124.2
[M+Na]+ 164.048208 133.6
[M-H]- 140.051714 126.9
[M+NH4]+ 159.092813 145.8
[M+K]+ 180.022148 131.9
[M+H-H2O]+ 124.056250 118.1
[M+HCOO]- 186.057191 149.1
[M+CH3COO]- 200.072841 176.4
[M+Na-2H]- 162.033656 130.8
[M]+ 141.05844142 122.7
[M]- 141.05953858 122.7
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