CID 36196

32621-25-3

Structural Information

Molecular Formula
C10H11N2
SMILES
CC1=CN=[N+](C2=CC=CC=C12)C
InChI
InChI=1S/C10H11N2/c1-8-7-11-12(2)10-6-4-3-5-9(8)10/h3-7H,1-2H3/q+1
InChIKey
OFMHEBCZNJZAFM-UHFFFAOYSA-N
Compound name
1,4-dimethylcinnolin-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.09222 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.09950 132.6
[M+Na]+ 182.08144 143.0
[M-H]- 158.08494 135.4
[M+NH4]+ 177.12604 152.2
[M+K]+ 198.05538 134.4
[M+H-H2O]+ 142.08948 128.2
[M+HCOO]- 204.09042 153.9
[M+CH3COO]- 218.10607 172.9
[M+Na-2H]- 180.06689 144.6
[M]+ 159.09167 132.3
[M]- 159.09277 132.3
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.