CID 25212868

1111213-54-7

Structural Information

Molecular Formula
C5H5BF3O
SMILES
[B-](C1=CC=C(O1)C)(F)(F)F
InChI
InChI=1S/C5H5BF3O/c1-4-2-3-5(10-4)6(7,8)9/h2-3H,1H3/q-1
InChIKey
HYMKCDZEVBXPQC-UHFFFAOYSA-N
Compound name
trifluoro-(5-methylfuran-2-yl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

149.03856 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.04584 130.5
[M+Na]+ 172.02778 139.1
[M+NH4]+ 167.07238 136.4
[M+K]+ 188.00172 137.1
[M-H]- 148.03128 127.9
[M+Na-2H]- 170.01323 133.1
[M]+ 149.03801 130.4
[M]- 149.03911 130.4
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.