CID 423644

Nsc155694

Structural Information

Molecular Formula
C20H21N2O
SMILES
CC1=C2C=C[N+](=CC2=C(C3=C1N(C4=C3C=C(C=C4)OC)C)C)C
InChI
InChI=1S/C20H21N2O/c1-12-17-11-21(3)9-8-15(17)13(2)20-19(12)16-10-14(23-5)6-7-18(16)22(20)4/h6-11H,1-5H3/q+1
InChIKey
PSMLZEJQSPVYCO-UHFFFAOYSA-N
Compound name
9-methoxy-2,5,6,11-tetramethylpyrido[4,3-b]carbazol-2-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

305.16537 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.17265 177.4
[M+Na]+ 328.15459 191.6
[M-H]- 304.15809 183.5
[M+NH4]+ 323.19919 195.7
[M+K]+ 344.12853 179.6
[M+H-H2O]+ 288.16263 171.7
[M+HCOO]- 350.16357 197.9
[M+CH3COO]- 364.17922 205.6
[M+Na-2H]- 326.14004 184.6
[M]+ 305.16482 184.6
[M]- 305.16592 184.6
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

patents stripe