CID 119030508

Potassium trifluoro(1-phenylazetidin-3-yl)boranuide

Structural Information

Molecular Formula
C9H10BF3N
SMILES
[B-](C1CN(C1)C2=CC=CC=C2)(F)(F)F
InChI
InChI=1S/C9H10BF3N/c11-10(12,13)8-6-14(7-8)9-4-2-1-3-5-9/h1-5,8H,6-7H2/q-1
InChIKey
MFRKUKYCXBQOIM-UHFFFAOYSA-N
Compound name
trifluoro-(1-phenylazetidin-3-yl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.08585 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.09313 133.3
[M+Na]+ 223.07507 140.0
[M-H]- 199.07857 133.0
[M+NH4]+ 218.11967 144.3
[M+K]+ 239.04901 139.9
[M+H-H2O]+ 183.08311 121.5
[M+HCOO]- 245.08405 149.4
[M+CH3COO]- 259.09970 184.8
[M+Na-2H]- 221.06052 138.3
[M]+ 200.08530 134.0
[M]- 200.08640 134.0
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.