CID 137964491

2,2-difluoro-2-(1-methoxycyclobutyl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H13F2NO
SMILES
COC1(CCC1)C(CN)(F)F
InChI
InChI=1S/C7H13F2NO/c1-11-6(3-2-4-6)7(8,9)5-10/h2-5,10H2,1H3
InChIKey
GODWRGSQYIEYPR-UHFFFAOYSA-N
Compound name
2,2-difluoro-2-(1-methoxycyclobutyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.09653 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.103806 135.5
[M+Na]+ 188.085748 141.0
[M-H]- 164.089254 136.0
[M+NH4]+ 183.130353 150.9
[M+K]+ 204.059688 143.1
[M+H-H2O]+ 148.093790 124.9
[M+HCOO]- 210.094731 154.1
[M+CH3COO]- 224.110381 183.0
[M+Na-2H]- 186.071196 141.2
[M]+ 165.09598142 139.9
[M]- 165.09707858 139.9
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.