CID 3074499

3,4-dihydro-4-oxo-n-propyl-2(1h)-cinnolineacetamide

Structural Information

Molecular Formula
C13H17N3O2
SMILES
CCCNC(=O)CN1CC(=O)C2=CC=CC=C2N1
InChI
InChI=1S/C13H17N3O2/c1-2-7-14-13(18)9-16-8-12(17)10-5-3-4-6-11(10)15-16/h3-6,15H,2,7-9H2,1H3,(H,14,18)
InChIKey
KYAZYJLAOHSPOY-UHFFFAOYSA-N
Compound name
2-(4-oxo-1,3-dihydrocinnolin-2-yl)-N-propylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.13208 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.139356 157.0
[M+Na]+ 270.121298 162.9
[M-H]- 246.124804 156.7
[M+NH4]+ 265.165903 171.6
[M+K]+ 286.095238 158.7
[M+H-H2O]+ 230.129340 148.9
[M+HCOO]- 292.130281 173.9
[M+CH3COO]- 306.145931 194.3
[M+Na-2H]- 268.106746 161.8
[M]+ 247.13153142 154.2
[M]- 247.13262858 154.2
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.