CID 87235030

1350729-26-8

Structural Information

Molecular Formula
C5H9BF3
SMILES
[B-](C1CC1(C)C)(F)(F)F
InChI
InChI=1S/C5H9BF3/c1-5(2)3-4(5)6(7,8)9/h4H,3H2,1-2H3/q-1
InChIKey
MWXJFRXLOYFOIR-UHFFFAOYSA-N
Compound name
(2,2-dimethylcyclopropyl)-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

137.07494 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.08222 118.0
[M+Na]+ 160.06416 128.6
[M-H]- 136.06766 118.0
[M+NH4]+ 155.10876 136.5
[M+K]+ 176.03810 127.5
[M+H-H2O]+ 120.07220 114.1
[M+HCOO]- 182.07314 136.7
[M+CH3COO]- 196.08879 175.3
[M+Na-2H]- 158.04961 124.5
[M]+ 137.07439 114.9
[M]- 137.07549 114.9
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

patents stripe