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

6
Patents

149.07494 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.08222 123.7
[M+Na]+ 172.06416 130.0
[M-H]- 148.06766 121.2
[M+NH4]+ 167.10876 144.1
[M+K]+ 188.03810 128.4
[M+H-H2O]+ 132.07220 118.7
[M+HCOO]- 194.07314 140.7
[M+CH3COO]- 208.08879 171.3
[M+Na-2H]- 170.04961 129.0
[M]+ 149.07439 113.5
[M]- 149.07549 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