CID 46738013

2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9h-carbazole

Structural Information

Molecular Formula
C18H20BNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)C4=CC=CC=C4N3
InChI
InChI=1S/C18H20BNO2/c1-17(2)18(3,4)22-19(21-17)12-9-10-14-13-7-5-6-8-15(13)20-16(14)11-12/h5-11,20H,1-4H3
InChIKey
RLSJGSFDSSYNPL-UHFFFAOYSA-N
Compound name
2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

156
Patents

293.15872 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.16600 165.6
[M+Na]+ 316.14794 177.6
[M-H]- 292.15144 174.3
[M+NH4]+ 311.19254 186.8
[M+K]+ 332.12188 174.0
[M+H-H2O]+ 276.15598 159.9
[M+HCOO]- 338.15692 184.0
[M+CH3COO]- 352.17257 179.0
[M+Na-2H]- 314.13339 170.5
[M]+ 293.15817 169.4
[M]- 293.15927 169.4
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

patents stripe