CID 6262929

Potassium trans-styryltrifluoroborate

Structural Information

Molecular Formula
C8H7BF3
SMILES
[B-](/C=C/C1=CC=CC=C1)(F)(F)F
InChI
InChI=1S/C8H7BF3/c10-9(11,12)7-6-8-4-2-1-3-5-8/h1-7H/q-1/b7-6+
InChIKey
COQVJDICQQLHIJ-VOTSOKGWSA-N
Compound name
trifluoro-[(E)-2-phenylethenyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

171.0593 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.066576 127.5
[M+Na]+ 194.048518 135.5
[M-H]- 170.052024 125.5
[M+NH4]+ 189.093123 147.3
[M+K]+ 210.022458 132.3
[M+H-H2O]+ 154.056560 122.3
[M+HCOO]- 216.057501 147.1
[M+CH3COO]- 230.073151 175.1
[M+Na-2H]- 192.033966 133.9
[M]+ 171.05875142 120.3
[M]- 171.05984858 120.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe