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

2
Patents

167.11102 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.11830 133.4
[M+Na]+ 190.10024 144.4
[M-H]- 166.10374 136.8
[M+NH4]+ 185.14484 155.1
[M+K]+ 206.07418 141.6
[M+H-H2O]+ 150.10828 127.8
[M+HCOO]- 212.10922 157.0
[M+CH3COO]- 226.12487 187.1
[M+Na-2H]- 188.08569 136.4
[M]+ 167.11047 132.8
[M]- 167.11157 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