CID 154577343

2418708-74-2

Structural Information

Molecular Formula
C8H13F2NO
SMILES
C1C(OCC12CC(C2)(F)F)CN
InChI
InChI=1S/C8H13F2NO/c9-8(10)3-7(4-8)1-6(2-11)12-5-7/h6H,1-5,11H2
InChIKey
ZFLHHQJBKICSIL-UHFFFAOYSA-N
Compound name
(2,2-difluoro-6-oxaspiro[3.4]octan-7-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.09653 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.103806 132.3
[M+Na]+ 200.085748 138.8
[M-H]- 176.089254 135.9
[M+NH4]+ 195.130353 150.1
[M+K]+ 216.059688 140.5
[M+H-H2O]+ 160.093790 122.8
[M+HCOO]- 222.094731 150.8
[M+CH3COO]- 236.110381 183.0
[M+Na-2H]- 198.071196 137.7
[M]+ 177.09598142 135.3
[M]- 177.09707858 135.3
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.