CID 12218945

9,9'-diethyl-9h,9'h-3,3'-bicarbazole

Structural Information

Molecular Formula
C28H24N2
SMILES
CCN1C2=C(C=C(C=C2)C3=CC4=C(C=C3)N(C5=CC=CC=C54)CC)C6=CC=CC=C61
InChI
InChI=1S/C28H24N2/c1-3-29-25-11-7-5-9-21(25)23-17-19(13-15-27(23)29)20-14-16-28-24(18-20)22-10-6-8-12-26(22)30(28)4-2/h5-18H,3-4H2,1-2H3
InChIKey
FHYBJLCZRQQVAM-UHFFFAOYSA-N
Compound name
9-ethyl-3-(9-ethylcarbazol-3-yl)carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

141
Patents

388.19394 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.20122 199.7
[M+Na]+ 411.18316 213.0
[M-H]- 387.18666 209.3
[M+NH4]+ 406.22776 216.4
[M+K]+ 427.15710 203.0
[M+H-H2O]+ 371.19120 189.5
[M+HCOO]- 433.19214 220.5
[M+CH3COO]- 447.20779 210.9
[M+Na-2H]- 409.16861 202.5
[M]+ 388.19339 206.8
[M]- 388.19449 206.8
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