CID 3047228

Brn 2110755

Structural Information

Molecular Formula
C9H16F3NO3Si
SMILES
C1CO[Si]2(OCCN1CCO2)CCC(F)(F)F
InChI
InChI=1S/C9H16F3NO3Si/c10-9(11,12)1-8-17-14-5-2-13(3-6-15-17)4-7-16-17/h1-8H2
InChIKey
SESZKYUJORLFJJ-UHFFFAOYSA-N
Compound name
1-(3,3,3-trifluoropropyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

271.08514 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.09242 114.7
[M+Na]+ 294.07436 114.7
[M-H]- 270.07786 114.7
[M+NH4]+ 289.11896 114.7
[M+K]+ 310.04830 114.8
[M+H-H2O]+ 254.08240 114.6
[M+HCOO]- 316.08334 114.7
[M+CH3COO]- 330.09899 114.6
[M+Na-2H]- 292.05981 114.5
[M]+ 271.08459 114.7
[M]- 271.08569 114.7
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

patents stripe