CID 162396501

Dtxsid201032719

Structural Information

Molecular Formula
C11H10F15NO
SMILES
C[N+](C)(CCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-]
InChI
InChI=1S/C11H10F15NO/c1-27(2,28)4-3-5(12,13)6(14,15)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)26/h3-4H2,1-2H3
InChIKey
FZNQTEZNMUSYEE-UHFFFAOYSA-N
Compound name
3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-pentadecafluoro-N,N-dimethylnonan-1-amine oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

457.05228 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 458.05956 185.0
[M+Na]+ 480.04150 189.9
[M-H]- 456.04500 190.8
[M+NH4]+ 475.08610 193.0
[M+K]+ 496.01544 198.8
[M+H-H2O]+ 440.04954 166.4
[M+HCOO]- 502.05048 206.5
[M+CH3COO]- 516.06613 228.0
[M+Na-2H]- 478.02695 181.6
[M]+ 457.05173 181.7
[M]- 457.05283 181.7
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.