CID 363476

Nsc628387

Structural Information

Molecular Formula
C16H16N2O3
SMILES
C1CCC(CC1)C(=O)NC2=CC(=O)C(=O)C3=C2N=CC=C3
InChI
InChI=1S/C16H16N2O3/c19-13-9-12(14-11(15(13)20)7-4-8-17-14)18-16(21)10-5-2-1-3-6-10/h4,7-10H,1-3,5-6H2,(H,18,21)
InChIKey
XAEBHPRULNWEMY-UHFFFAOYSA-N
Compound name
N-(5,6-dioxoquinolin-8-yl)cyclohexanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.1161 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.123376 163.2
[M+Na]+ 307.105318 168.4
[M-H]- 283.108824 168.5
[M+NH4]+ 302.149923 177.7
[M+K]+ 323.079258 164.5
[M+H-H2O]+ 267.113360 154.4
[M+HCOO]- 329.114301 180.7
[M+CH3COO]- 343.129951 202.4
[M+Na-2H]- 305.090766 166.7
[M]+ 284.11555142 158.4
[M]- 284.11664858 158.4
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.