CID 71306544

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

Structural Information

Molecular Formula
C20H24BNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N(C4=CC=CC=C43)CC
InChI
InChI=1S/C20H24BNO2/c1-6-22-17-10-8-7-9-15(17)16-13-14(11-12-18(16)22)21-23-19(2,3)20(4,5)24-21/h7-13H,6H2,1-5H3
InChIKey
WZHQDHUWGUPVQF-UHFFFAOYSA-N
Compound name
9-ethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

321.19 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.19728 173.9
[M+Na]+ 344.17922 186.1
[M-H]- 320.18272 183.8
[M+NH4]+ 339.22382 194.9
[M+K]+ 360.15316 183.0
[M+H-H2O]+ 304.18726 167.8
[M+HCOO]- 366.18820 192.9
[M+CH3COO]- 380.20385 187.3
[M+Na-2H]- 342.16467 177.4
[M]+ 321.18945 180.3
[M]- 321.19055 180.3
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