CID 46739284

Potassium trifluoro(3-methoxy-3-oxopropyl)boranuide

Structural Information

Molecular Formula
C4H7BF3O2
SMILES
[B-](CCC(=O)OC)(F)(F)F
InChI
InChI=1S/C4H7BF3O2/c1-10-4(9)2-3-5(6,7)8/h2-3H2,1H3/q-1
InChIKey
JTWGSLFVTPCSBH-UHFFFAOYSA-N
Compound name
trifluoro-(3-methoxy-3-oxopropyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.04912 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.05640 124.6
[M+Na]+ 178.03834 132.7
[M-H]- 154.04184 119.6
[M+NH4]+ 173.08294 145.1
[M+K]+ 194.01228 132.7
[M+H-H2O]+ 138.04638 120.6
[M+HCOO]- 200.04732 143.3
[M+CH3COO]- 214.06297 172.4
[M+Na-2H]- 176.02379 129.2
[M]+ 155.04857 120.5
[M]- 155.04967 120.5
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.