CID 3728185

4-fluoro-2,3,5,6-tetramethyl-phenylamine

Structural Information

Molecular Formula
C10H14FN
SMILES
CC1=C(C(=C(C(=C1N)C)C)F)C
InChI
InChI=1S/C10H14FN/c1-5-7(3)10(12)8(4)6(2)9(5)11/h12H2,1-4H3
InChIKey
OTZXMVFEAZECDY-UHFFFAOYSA-N
Compound name
4-fluoro-2,3,5,6-tetramethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

167.11102 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.118296 133.4
[M+Na]+ 190.100238 144.4
[M-H]- 166.103744 136.8
[M+NH4]+ 185.144843 155.1
[M+K]+ 206.074178 141.6
[M+H-H2O]+ 150.108280 127.8
[M+HCOO]- 212.109221 157.0
[M+CH3COO]- 226.124871 187.1
[M+Na-2H]- 188.085686 136.4
[M]+ 167.11047142 132.8
[M]- 167.11156858 132.8
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