CID 494279

80271-02-9

Structural Information

Molecular Formula
C16H12N2O2
SMILES
CON1C2=CC=CC=C2C3=[N+](C4=CC=CC=C4C=C31)[O-]
InChI
InChI=1S/C16H12N2O2/c1-20-18-14-9-5-3-7-12(14)16-15(18)10-11-6-2-4-8-13(11)17(16)19/h2-10H,1H3
InChIKey
NRHVXGMPQMDBOV-UHFFFAOYSA-N
Compound name
10-methoxy-5-oxidoindolo[3,2-b]quinolin-5-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.08987 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.09715 158.0
[M+Na]+ 287.07909 170.2
[M-H]- 263.08259 162.0
[M+NH4]+ 282.12369 176.1
[M+K]+ 303.05303 159.7
[M+H-H2O]+ 247.08713 154.3
[M+HCOO]- 309.08807 179.5
[M+CH3COO]- 323.10372 189.5
[M+Na-2H]- 285.06454 169.1
[M]+ 264.08932 161.4
[M]- 264.09042 161.4
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.