CID 83855363

1,1-difluoro-2-methyl-1-phenylpropan-2-amine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

185.10161 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.108886 138.1
[M+Na]+ 208.090828 145.3
[M-H]- 184.094334 138.7
[M+NH4]+ 203.135433 157.5
[M+K]+ 224.064768 142.7
[M+H-H2O]+ 168.098870 131.3
[M+HCOO]- 230.099811 157.5
[M+CH3COO]- 244.115461 184.8
[M+Na-2H]- 206.076276 145.2
[M]+ 185.10106142 133.3
[M]- 185.10215858 133.3
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