CID 165997282

En300-28316302

Structural Information

Molecular Formula
C7H11BF3O3
SMILES
[B-](C1(COC1)CC(=O)OCC)(F)(F)F
InChI
InChI=1S/C7H11BF3O3/c1-2-14-6(12)3-7(4-13-5-7)8(9,10)11/h2-5H2,1H3/q-1
InChIKey
TZFSXHLAQCFOHT-UHFFFAOYSA-N
Compound name
[3-(2-ethoxy-2-oxoethyl)oxetan-3-yl]-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.07533 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.08261 152.4
[M+Na]+ 234.06455 154.5
[M+NH4]+ 229.10915 153.9
[M+K]+ 250.03849 152.0
[M-H]- 210.06805 145.6
[M+Na-2H]- 232.05000 151.1
[M]+ 211.07478 149.1
[M]- 211.07588 149.1
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.