CID 3080054

11h-pyrido(3,2-a)carbazole, 3-chloro-11-ethyl-

Structural Information

Molecular Formula
C17H13ClN2
SMILES
CCN1C2=CC=CC=C2C3=C1C4=C(C=C3)N=C(C=C4)Cl
InChI
InChI=1S/C17H13ClN2/c1-2-20-15-6-4-3-5-11(15)12-7-9-14-13(17(12)20)8-10-16(18)19-14/h3-10H,2H2,1H3
InChIKey
QMSCTDWMWZHLAQ-UHFFFAOYSA-N
Compound name
3-chloro-11-ethylpyrido[3,2-a]carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.07672 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.08400 163.1
[M+Na]+ 303.06594 177.7
[M-H]- 279.06944 167.9
[M+NH4]+ 298.11054 182.9
[M+K]+ 319.03988 169.3
[M+H-H2O]+ 263.07398 155.1
[M+HCOO]- 325.07492 180.5
[M+CH3COO]- 339.09057 176.5
[M+Na-2H]- 301.05139 171.3
[M]+ 280.07617 170.2
[M]- 280.07727 170.2
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.