CID 117303914

1-[3-(difluoromethoxy)phenyl]cyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C11H13F2NO
SMILES
C1CC(C1)(C2=CC(=CC=C2)OC(F)F)N
InChI
InChI=1S/C11H13F2NO/c12-10(13)15-9-4-1-3-8(7-9)11(14)5-2-6-11/h1,3-4,7,10H,2,5-6,14H2
InChIKey
YCSNNCZZIHFWSR-UHFFFAOYSA-N
Compound name
1-[3-(difluoromethoxy)phenyl]cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.09653 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.10381 151.1
[M+Na]+ 236.08575 156.4
[M+NH4]+ 231.13035 155.7
[M+K]+ 252.05969 150.5
[M-H]- 212.08925 149.3
[M+Na-2H]- 234.07120 155.4
[M]+ 213.09598 150.1
[M]- 213.09708 150.1
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.