CID 3466040

Dimesitylboron fluoride

Structural Information

Molecular Formula
C18H22BF
SMILES
B(C1=C(C=C(C=C1C)C)C)(C2=C(C=C(C=C2C)C)C)F
InChI
InChI=1S/C18H22BF/c1-11-7-13(3)17(14(4)8-11)19(20)18-15(5)9-12(2)10-16(18)6/h7-10H,1-6H3
InChIKey
WZWGERGANZMXOM-UHFFFAOYSA-N
Compound name
fluoro-bis(2,4,6-trimethylphenyl)borane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

276
Patents

268.17987 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.18715 160.0
[M+Na]+ 291.16909 170.1
[M-H]- 267.17259 166.5
[M+NH4]+ 286.21369 178.0
[M+K]+ 307.14303 165.4
[M+H-H2O]+ 251.17713 152.5
[M+HCOO]- 313.17807 180.8
[M+CH3COO]- 327.19372 207.0
[M+Na-2H]- 289.15454 159.8
[M]+ 268.17932 161.6
[M]- 268.18042 161.6
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