CID 51888252

1807939-84-9

Structural Information

Molecular Formula
C10H11F2NO
SMILES
C1[C@H]([C@@H]1N)C2=CC=C(C=C2)OC(F)F
InChI
InChI=1S/C10H11F2NO/c11-10(12)14-7-3-1-6(2-4-7)8-5-9(8)13/h1-4,8-10H,5,13H2/t8-,9+/m0/s1
InChIKey
SMNZDNYMLPJBCK-DTWKUNHWSA-N
Compound name
trans-(1R,2S)-2-[4-(difluoromethoxy)phenyl]cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.08087 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.088146 133.5
[M+Na]+ 222.070088 143.0
[M-H]- 198.073594 138.4
[M+NH4]+ 217.114693 147.6
[M+K]+ 238.044028 139.5
[M+H-H2O]+ 182.078130 125.2
[M+HCOO]- 244.079071 155.9
[M+CH3COO]- 258.094721 190.6
[M+Na-2H]- 220.055536 137.7
[M]+ 199.08032142 132.7
[M]- 199.08141858 132.7
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.