CID 71306505

Potassium trifluoro[3-(piperidine-1-carbonyl)phenyl]boranuide

Structural Information

Molecular Formula
C12H14BF3NO
SMILES
[B-](C1=CC(=CC=C1)C(=O)N2CCCCC2)(F)(F)F
InChI
InChI=1S/C12H14BF3NO/c14-13(15,16)11-6-4-5-10(9-11)12(18)17-7-2-1-3-8-17/h4-6,9H,1-3,7-8H2/q-1
InChIKey
UKDAMTFCMHWBAR-UHFFFAOYSA-N
Compound name
trifluoro-[3-(piperidine-1-carbonyl)phenyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.11206 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.11934 151.4
[M+Na]+ 279.10128 156.4
[M-H]- 255.10478 150.2
[M+NH4]+ 274.14588 165.8
[M+K]+ 295.07522 152.7
[M+H-H2O]+ 239.10932 143.5
[M+HCOO]- 301.11026 164.6
[M+CH3COO]- 315.12591 190.2
[M+Na-2H]- 277.08673 153.5
[M]+ 256.11151 140.3
[M]- 256.11261 140.3
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

No patent data available for this compound.