CID 102487013

1370291-66-9

Structural Information

Molecular Formula
C6H9BF3O
SMILES
[B-](C(=O)CCCC=C)(F)(F)F
InChI
InChI=1S/C6H9BF3O/c1-2-3-4-5-6(11)7(8,9)10/h2H,1,3-5H2/q-1
InChIKey
AUSFYWRTHFEQOU-UHFFFAOYSA-N
Compound name
trifluoro(hex-5-enoyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.06985 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.07713 129.3
[M+Na]+ 188.05907 136.8
[M-H]- 164.06257 124.0
[M+NH4]+ 183.10367 149.3
[M+K]+ 204.03301 135.3
[M+H-H2O]+ 148.06711 125.2
[M+HCOO]- 210.06805 147.3
[M+CH3COO]- 224.08370 176.3
[M+Na-2H]- 186.04452 132.8
[M]+ 165.06930 123.9
[M]- 165.07040 123.9
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.