CID 166000160

En300-26870918

Structural Information

Molecular Formula
C6H9BF3
SMILES
[B-](CC1CC(=C)C1)(F)(F)F
InChI
InChI=1S/C6H9BF3/c1-5-2-6(3-5)4-7(8,9)10/h6H,1-4H2/q-1
InChIKey
CCYAAYCGLNISPB-UHFFFAOYSA-N
Compound name
trifluoro-[(3-methylidenecyclobutyl)methyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

149.07494 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.082216 123.9
[M+Na]+ 172.064158 130.7
[M-H]- 148.067664 122.2
[M+NH4]+ 167.108763 138.4
[M+K]+ 188.038098 131.7
[M+H-H2O]+ 132.072200 114.9
[M+HCOO]- 194.073141 140.8
[M+CH3COO]- 208.088791 177.2
[M+Na-2H]- 170.049606 127.7
[M]+ 149.07439142 124.7
[M]- 149.07548858 124.7
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.