CID 75356155

1-(3,4-difluorophenyl)-2-methyl-2-(pyrrolidin-1-yl)propan-1-amine

Structural Information

Molecular Formula
C14H20F2N2
SMILES
CC(C)(C(C1=CC(=C(C=C1)F)F)N)N2CCCC2
InChI
InChI=1S/C14H20F2N2/c1-14(2,18-7-3-4-8-18)13(17)10-5-6-11(15)12(16)9-10/h5-6,9,13H,3-4,7-8,17H2,1-2H3
InChIKey
WJXRTQWHUVATOZ-UHFFFAOYSA-N
Compound name
1-(3,4-difluorophenyl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.15945 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.16673 158.7
[M+Na]+ 277.14867 164.4
[M-H]- 253.15217 160.6
[M+NH4]+ 272.19327 175.6
[M+K]+ 293.12261 160.6
[M+H-H2O]+ 237.15671 149.7
[M+HCOO]- 299.15765 175.3
[M+CH3COO]- 313.17330 198.4
[M+Na-2H]- 275.13412 158.6
[M]+ 254.15890 151.9
[M]- 254.16000 151.9
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.