CID 114782803

1599396-58-3

Structural Information

Molecular Formula
C6H11F2NO
SMILES
C1C(CC1OC(F)F)CN
InChI
InChI=1S/C6H11F2NO/c7-6(8)10-5-1-4(2-5)3-9/h4-6H,1-3,9H2
InChIKey
LKSVUKDWRPZUMX-UHFFFAOYSA-N
Compound name
[3-(difluoromethoxy)cyclobutyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.08087 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.088146 130.6
[M+Na]+ 174.070088 135.8
[M-H]- 150.073594 131.0
[M+NH4]+ 169.114693 144.6
[M+K]+ 190.044028 138.2
[M+H-H2O]+ 134.078130 118.3
[M+HCOO]- 196.079071 150.0
[M+CH3COO]- 210.094721 182.1
[M+Na-2H]- 172.055536 133.1
[M]+ 151.08032142 134.5
[M]- 151.08141858 134.5
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

No patent data available for this compound.