CID 137964524

2365173-78-8

Structural Information

Molecular Formula
C4H5BF3O
SMILES
[B-](C=C1COC1)(F)(F)F
InChI
InChI=1S/C4H5BF3O/c6-5(7,8)1-4-2-9-3-4/h1H,2-3H2/q-1
InChIKey
MUCKDMPTCKNGNK-UHFFFAOYSA-N
Compound name
trifluoro(oxetan-3-ylidenemethyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

137.03856 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.045836 115.7
[M+Na]+ 160.027778 122.4
[M-H]- 136.031284 114.6
[M+NH4]+ 155.072383 129.2
[M+K]+ 176.001718 125.4
[M+H-H2O]+ 120.035820 106.7
[M+HCOO]- 182.036761 132.8
[M+CH3COO]- 196.052411 171.4
[M+Na-2H]- 158.013226 122.6
[M]+ 137.03801142 117.3
[M]- 137.03910858 117.3
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