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

31
Patents

154.09062 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.097896 130.0
[M+Na]+ 177.079838 138.3
[M-H]- 153.083344 134.0
[M+NH4]+ 172.124443 151.4
[M+K]+ 193.053778 137.2
[M+H-H2O]+ 137.087880 123.2
[M+HCOO]- 199.088821 155.8
[M+CH3COO]- 213.104471 185.8
[M+Na-2H]- 175.065286 135.5
[M]+ 154.09007142 127.9
[M]- 154.09116858 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