CID 14674

1228-30-4

Structural Information

Molecular Formula
C18H26FNO
SMILES
C1CCC2(CC1)CCN(CC2)CCOC3=CC=C(C=C3)F
InChI
InChI=1S/C18H26FNO/c19-16-4-6-17(7-5-16)21-15-14-20-12-10-18(11-13-20)8-2-1-3-9-18/h4-7H,1-3,8-15H2
InChIKey
QJWZDBZEYMUZSI-UHFFFAOYSA-N
Compound name
3-[2-(4-fluorophenoxy)ethyl]-3-azaspiro[5.5]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.19983 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.20711 172.3
[M+Na]+ 314.18905 174.8
[M-H]- 290.19255 176.1
[M+NH4]+ 309.23365 187.7
[M+K]+ 330.16299 170.4
[M+H-H2O]+ 274.19709 161.5
[M+HCOO]- 336.19803 185.7
[M+CH3COO]- 350.21368 180.6
[M+Na-2H]- 312.17450 174.4
[M]+ 291.19928 163.5
[M]- 291.20038 163.5
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.