CID 22063500

1-(2,4-difluorophenyl)-2-methylpropan-2-amine hydrochloride

Structural Information

Molecular Formula
C10H13F2N
SMILES
CC(C)(CC1=C(C=C(C=C1)F)F)N
InChI
InChI=1S/C10H13F2N/c1-10(2,13)6-7-3-4-8(11)5-9(7)12/h3-5H,6,13H2,1-2H3
InChIKey
ZAWIHARPILBRQM-UHFFFAOYSA-N
Compound name
1-(2,4-difluorophenyl)-2-methylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

185.10161 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.108886 137.9
[M+Na]+ 208.090828 146.5
[M-H]- 184.094334 138.9
[M+NH4]+ 203.135433 157.8
[M+K]+ 224.064768 143.5
[M+H-H2O]+ 168.098870 131.0
[M+HCOO]- 230.099811 158.8
[M+CH3COO]- 244.115461 186.6
[M+Na-2H]- 206.076276 142.8
[M]+ 185.10106142 134.3
[M]- 185.10215858 134.3
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