CID 72208066

1363383-40-7

Structural Information

Molecular Formula
C6H11F2NO
SMILES
C1C(CC1(F)F)(CN)CO
InChI
InChI=1S/C6H11F2NO/c7-6(8)1-5(2-6,3-9)4-10/h10H,1-4,9H2
InChIKey
IGUARLULXUYQKD-UHFFFAOYSA-N
Compound name
[1-(aminomethyl)-3,3-difluorocyclobutyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

151.08087 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.088146 131.9
[M+Na]+ 174.070088 138.8
[M-H]- 150.073594 131.8
[M+NH4]+ 169.114693 149.4
[M+K]+ 190.044028 139.9
[M+H-H2O]+ 134.078130 122.8
[M+HCOO]- 196.079071 150.9
[M+CH3COO]- 210.094721 178.1
[M+Na-2H]- 172.055536 137.4
[M]+ 151.08032142 135.4
[M]- 151.08141858 135.4
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

patents stripe