CID 209854

Benz(3,4)indolo(1,2-a)benzimidazole

Structural Information

Molecular Formula
C17H10N2
SMILES
C1=CC=C2C(=C1)N=C3N2C4=CC=CC5=C4C3=CC=C5
InChI
InChI=1S/C17H10N2/c1-2-9-14-13(8-1)18-17-12-7-3-5-11-6-4-10-15(16(11)12)19(14)17/h1-10H
InChIKey
ISINGYZTIIWJRJ-UHFFFAOYSA-N
Compound name
2,9-diazapentacyclo[9.7.1.02,10.03,8.015,19]nonadeca-1(18),3,5,7,9,11,13,15(19),16-nonaene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

242.0844 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.09168 151.5
[M+Na]+ 265.07362 165.4
[M-H]- 241.07712 157.5
[M+NH4]+ 260.11822 174.6
[M+K]+ 281.04756 158.4
[M+H-H2O]+ 225.08166 144.0
[M+HCOO]- 287.08260 174.4
[M+CH3COO]- 301.09825 165.9
[M+Na-2H]- 263.05907 160.8
[M]+ 242.08385 157.6
[M]- 242.08495 157.6
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