CID 454718

Indenoquinoline 10(me2netnh)

Structural Information

Molecular Formula
C20H21N3
SMILES
CN(C)CCNC1=C2CC3=CC=CC=C3C2=NC4=CC=CC=C41
InChI
InChI=1S/C20H21N3/c1-23(2)12-11-21-19-16-9-5-6-10-18(16)22-20-15-8-4-3-7-14(15)13-17(19)20/h3-10H,11-13H2,1-2H3,(H,21,22)
InChIKey
DMRFORMHEBXQFL-UHFFFAOYSA-N
Compound name
N-(11H-indeno[1,2-b]quinolin-10-yl)-N',N'-dimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

303.17355 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.18083 170.7
[M+Na]+ 326.16277 178.3
[M-H]- 302.16627 176.8
[M+NH4]+ 321.20737 189.4
[M+K]+ 342.13671 172.8
[M+H-H2O]+ 286.17081 161.9
[M+HCOO]- 348.17175 192.8
[M+CH3COO]- 362.18740 182.1
[M+Na-2H]- 324.14822 177.5
[M]+ 303.17300 172.8
[M]- 303.17410 172.8
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.