CID 62197362

[1-(2,4-difluorophenyl)propan-2-yl](methyl)amine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.10161 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.10889 137.7
[M+Na]+ 208.09083 145.5
[M-H]- 184.09433 138.9
[M+NH4]+ 203.13543 157.6
[M+K]+ 224.06477 142.9
[M+H-H2O]+ 168.09887 130.1
[M+HCOO]- 230.09981 159.8
[M+CH3COO]- 244.11546 187.8
[M+Na-2H]- 206.07628 141.8
[M]+ 185.10106 135.0
[M]- 185.10216 135.0
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

No patent data available for this compound.