CID 62195914

1-(2,4-difluorophenyl)-n-ethylpropan-2-amine

Structural Information

Molecular Formula
C11H15F2N
SMILES
CCNC(C)CC1=C(C=C(C=C1)F)F
InChI
InChI=1S/C11H15F2N/c1-3-14-8(2)6-9-4-5-10(12)7-11(9)13/h4-5,7-8,14H,3,6H2,1-2H3
InChIKey
UMTJQTYXDACVPM-UHFFFAOYSA-N
Compound name
1-(2,4-difluorophenyl)-N-ethylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.11725 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.12453 142.4
[M+Na]+ 222.10647 149.8
[M-H]- 198.10997 143.5
[M+NH4]+ 217.15107 161.8
[M+K]+ 238.08041 147.0
[M+H-H2O]+ 182.11451 134.7
[M+HCOO]- 244.11545 164.2
[M+CH3COO]- 258.13110 190.8
[M+Na-2H]- 220.09192 145.9
[M]+ 199.11670 140.1
[M]- 199.11780 140.1
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.