CID 13707158

10,15-dihydro-5h-diindolo[3,2-a:3',2'-c]carbazole

Structural Information

Molecular Formula
C24H15N3
SMILES
C1=CC=C2C(=C1)C3=C(N2)C4=C(C5=C3NC6=CC=CC=C65)NC7=CC=CC=C74
InChI
InChI=1S/C24H15N3/c1-4-10-16-13(7-1)19-22(25-16)20-15-9-3-6-12-18(15)27-24(20)21-14-8-2-5-11-17(14)26-23(19)21/h1-12,25-27H
InChIKey
IQRFZFGTHZJRFV-UHFFFAOYSA-N
Compound name
9,18,27-triazaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1(20),2(10),3,5,7,11(19),12,14,16,21,23,25-dodecaene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

78
Patents

345.1266 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.13388 174.5
[M+Na]+ 368.11582 189.3
[M-H]- 344.11932 180.0
[M+NH4]+ 363.16042 193.4
[M+K]+ 384.08976 178.1
[M+H-H2O]+ 328.12386 167.5
[M+HCOO]- 390.12480 191.9
[M+CH3COO]- 404.14045 186.1
[M+Na-2H]- 366.10127 180.3
[M]+ 345.12605 178.8
[M]- 345.12715 178.8
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