CID 23547996

2-fluoro-n1,n1-dimethylbenzene-1,4-diamine

Structural Information

Molecular Formula
C8H11FN2
SMILES
CN(C)C1=C(C=C(C=C1)N)F
InChI
InChI=1S/C8H11FN2/c1-11(2)8-4-3-6(10)5-7(8)9/h3-5H,10H2,1-2H3
InChIKey
HWMMSIBCJCJIJM-UHFFFAOYSA-N
Compound name
2-fluoro-1-N,1-N-dimethylbenzene-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

154.09062 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.09790 130.0
[M+Na]+ 177.07984 138.3
[M-H]- 153.08334 134.0
[M+NH4]+ 172.12444 151.4
[M+K]+ 193.05378 137.2
[M+H-H2O]+ 137.08788 123.2
[M+HCOO]- 199.08882 155.8
[M+CH3COO]- 213.10447 185.8
[M+Na-2H]- 175.06529 135.5
[M]+ 154.09007 127.9
[M]- 154.09117 127.9
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