CID 155822468

2503208-95-3

Structural Information

Molecular Formula
C11H17F2NO2
SMILES
COC(=O)C1(CC2(C1)CCC(CC2)(F)F)N
InChI
InChI=1S/C11H17F2NO2/c1-16-8(15)10(14)6-9(7-10)2-4-11(12,13)5-3-9/h2-7,14H2,1H3
InChIKey
FRIODMGXHYKLDX-UHFFFAOYSA-N
Compound name
methyl 2-amino-7,7-difluorospiro[3.5]nonane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.12274 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.13002 153.7
[M+Na]+ 256.11196 159.2
[M-H]- 232.11546 156.3
[M+NH4]+ 251.15656 170.5
[M+K]+ 272.08590 160.3
[M+H-H2O]+ 216.12000 143.9
[M+HCOO]- 278.12094 169.2
[M+CH3COO]- 292.13659 193.4
[M+Na-2H]- 254.09741 157.2
[M]+ 233.12219 155.6
[M]- 233.12329 155.6
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.