CID 485487

5-(cyclopropylmethyl)-10h-indolo[3,2-b]quinolin-5-ium

Structural Information

Molecular Formula
C19H17N2
SMILES
C1CC1C[N+]2=C3C4=CC=CC=C4NC3=CC5=CC=CC=C52
InChI
InChI=1S/C19H16N2/c1-4-8-18-14(5-1)11-17-19(21(18)12-13-9-10-13)15-6-2-3-7-16(15)20-17/h1-8,11,13H,9-10,12H2/p+1
InChIKey
IASRDACRVGTONP-UHFFFAOYSA-O
Compound name
5-(cyclopropylmethyl)-10H-indolo[3,2-b]quinolin-5-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

273.13916 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.14644 161.4
[M+Na]+ 296.12838 174.2
[M-H]- 272.13188 168.1
[M+NH4]+ 291.17298 174.3
[M+K]+ 312.10232 160.3
[M+H-H2O]+ 256.13642 155.6
[M+HCOO]- 318.13736 181.4
[M+CH3COO]- 332.15301 173.0
[M+Na-2H]- 294.11383 171.7
[M]+ 273.13861 164.0
[M]- 273.13971 164.0
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.