CID 46318059

Trifluoro(pentyl)boranuide

Structural Information

Molecular Formula
C5H11BF3
SMILES
[B-](CCCCC)(F)(F)F
InChI
InChI=1S/C5H11BF3/c1-2-3-4-5-6(7,8)9/h2-5H2,1H3/q-1
InChIKey
VWAVGHJLXBYGIW-UHFFFAOYSA-N
Compound name
trifluoro(pentyl)boranuide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

269
Patents

139.09059 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.097866 124.6
[M+Na]+ 162.079808 132.1
[M-H]- 138.083314 119.3
[M+NH4]+ 157.124413 145.9
[M+K]+ 178.053748 131.3
[M+H-H2O]+ 122.087850 120.6
[M+HCOO]- 184.088791 143.1
[M+CH3COO]- 198.104441 172.7
[M+Na-2H]- 160.065256 129.7
[M]+ 139.09004142 119.3
[M]- 139.09113858 119.3
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