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]+ 265.097146 158.0
[M+Na]+ 287.079088 170.2
[M-H]- 263.082594 162.0
[M+NH4]+ 282.123693 176.1
[M+K]+ 303.053028 159.7
[M+H-H2O]+ 247.087130 154.3
[M+HCOO]- 309.088071 179.5
[M+CH3COO]- 323.103721 189.5
[M+Na-2H]- 285.064536 169.1
[M]+ 264.08932142 161.4
[M]- 264.09041858 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.