CID 97057963

2648945-40-6

Structural Information

Molecular Formula
C11H13F2NO
SMILES
C1CC1(CN)C2=CC(=CC=C2)OC(F)F
InChI
InChI=1S/C11H13F2NO/c12-10(13)15-9-3-1-2-8(6-9)11(7-14)4-5-11/h1-3,6,10H,4-5,7,14H2
InChIKey
UYODAACALKCSSU-UHFFFAOYSA-N
Compound name
[1-[3-(difluoromethoxy)phenyl]cyclopropyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.09653 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.10381 148.9
[M+Na]+ 236.08575 159.4
[M+NH4]+ 231.13035 157.7
[M+K]+ 252.05969 153.6
[M-H]- 212.08925 156.3
[M+Na-2H]- 234.07120 158.2
[M]+ 213.09598 153.4
[M]- 213.09708 153.4
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.