CID 91663012

1807941-11-2

Structural Information

Molecular Formula
C6H11F2NO
SMILES
C1C[C@H]([C@@H](C1)OC(F)F)N
InChI
InChI=1S/C6H11F2NO/c7-6(8)10-5-3-1-2-4(5)9/h4-6H,1-3,9H2/t4-,5-/m1/s1
InChIKey
HDAQBVUGOMOFIG-RFZPGFLSSA-N
Compound name
trans-(1R,2R)-2-(difluoromethoxy)cyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

151.08087 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.088146 129.0
[M+Na]+ 174.070088 135.2
[M-H]- 150.073594 129.1
[M+NH4]+ 169.114693 151.1
[M+K]+ 190.044028 134.4
[M+H-H2O]+ 134.078130 121.9
[M+HCOO]- 196.079071 149.7
[M+CH3COO]- 210.094721 176.7
[M+Na-2H]- 172.055536 130.6
[M]+ 151.08032142 122.5
[M]- 151.08141858 122.5
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