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]+ 150.08222 123.9
[M+Na]+ 172.06416 130.7
[M-H]- 148.06766 122.2
[M+NH4]+ 167.10876 138.4
[M+K]+ 188.03810 131.7
[M+H-H2O]+ 132.07220 114.9
[M+HCOO]- 194.07314 140.8
[M+CH3COO]- 208.08879 177.2
[M+Na-2H]- 170.04961 127.7
[M]+ 149.07439 124.7
[M]- 149.07549 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.