CID 49761752

1187951-61-6

Structural Information

Molecular Formula
C8H10BF3N
SMILES
[B-](C1=CC=C(C=C1)N(C)C)(F)(F)F
InChI
InChI=1S/C8H10BF3N/c1-13(2)8-5-3-7(4-6-8)9(10,11)12/h3-6H,1-2H3/q-1
InChIKey
QRNNFAIIFDDNNF-UHFFFAOYSA-N
Compound name
[4-(dimethylamino)phenyl]-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.08585 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.09313 132.1
[M+Na]+ 211.07507 139.9
[M-H]- 187.07857 131.7
[M+NH4]+ 206.11967 151.7
[M+K]+ 227.04901 138.5
[M+H-H2O]+ 171.08311 126.3
[M+HCOO]- 233.08405 152.8
[M+CH3COO]- 247.09970 185.9
[M+Na-2H]- 209.06052 137.2
[M]+ 188.08530 126.4
[M]- 188.08640 126.4
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.