CID 71306519

Potassium [4-(diethylamine-1-carbonyl)phenyl]trifluoroborate

Structural Information

Molecular Formula
C11H14BF3NO
SMILES
[B-](C1=CC=C(C=C1)C(=O)N(CC)CC)(F)(F)F
InChI
InChI=1S/C11H14BF3NO/c1-3-16(4-2)11(17)9-5-7-10(8-6-9)12(13,14)15/h5-8H,3-4H2,1-2H3/q-1
InChIKey
HTROAWGOOMQABF-UHFFFAOYSA-N
Compound name
[4-(diethylcarbamoyl)phenyl]-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.11206 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.11934 148.5
[M+Na]+ 267.10128 155.1
[M-H]- 243.10478 147.7
[M+NH4]+ 262.14588 165.7
[M+K]+ 283.07522 153.3
[M+H-H2O]+ 227.10932 142.1
[M+HCOO]- 289.11026 167.7
[M+CH3COO]- 303.12591 196.1
[M+Na-2H]- 265.08673 150.9
[M]+ 244.11151 143.9
[M]- 244.11261 143.9
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

No patent data available for this compound.