CID 165360437

Dtxsid501338732

Structural Information

Molecular Formula
C28H22N2
SMILES
C1C[C@@H]([C@@H]1N2C3=CC=CC=C3C4=CC=CC=C42)N5C6=CC=CC=C6C7=CC=CC=C75
InChI
InChI=1S/C28H22N2/c1-5-13-23-19(9-1)20-10-2-6-14-24(20)29(23)27-17-18-28(27)30-25-15-7-3-11-21(25)22-12-4-8-16-26(22)30/h1-16,27-28H,17-18H2/t27-,28+
InChIKey
HGJYDHFRXRTNGV-HNRBIFIRSA-N
Compound name
9-[(1S,2R)-2-carbazol-9-ylcyclobutyl]carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

386.17828 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.185556 189.0
[M+Na]+ 409.167498 200.3
[M-H]- 385.171004 200.8
[M+NH4]+ 404.212103 199.2
[M+K]+ 425.141438 193.7
[M+H-H2O]+ 369.175540 174.2
[M+HCOO]- 431.176481 208.4
[M+CH3COO]- 445.192131 199.9
[M+Na-2H]- 407.152946 192.3
[M]+ 386.17773142 201.2
[M]- 386.17882858 201.2
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.