CID 55267849

1186667-20-8

Structural Information

Molecular Formula
C6H9BF3
SMILES
[B-](C1=CCCCC1)(F)(F)F
InChI
InChI=1S/C6H9BF3/c8-7(9,10)6-4-2-1-3-5-6/h4H,1-3,5H2/q-1
InChIKey
DOBVFICVGYWCSU-UHFFFAOYSA-N
Compound name
cyclohexen-1-yl(trifluoro)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

149.07494 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.082216 123.7
[M+Na]+ 172.064158 130.0
[M-H]- 148.067664 121.2
[M+NH4]+ 167.108763 144.1
[M+K]+ 188.038098 128.4
[M+H-H2O]+ 132.072200 118.7
[M+HCOO]- 194.073141 140.7
[M+CH3COO]- 208.088791 171.3
[M+Na-2H]- 170.049606 129.0
[M]+ 149.07439142 113.5
[M]- 149.07548858 113.5
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

patents stripe