CID 12518645

73568-43-1

Structural Information

Molecular Formula
C10H6ClNO2
SMILES
C1=CC2=C(C=C1Cl)NC(=O)C(=C2)C=O
InChI
InChI=1S/C10H6ClNO2/c11-8-2-1-6-3-7(5-13)10(14)12-9(6)4-8/h1-5H,(H,12,14)
InChIKey
SLMKBPCYPXSKPF-UHFFFAOYSA-N
Compound name
7-chloro-2-oxo-1H-quinoline-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

207.00871 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.01599 137.9
[M+Na]+ 229.99793 154.1
[M+NH4]+ 225.04253 146.8
[M+K]+ 245.97187 146.3
[M-H]- 206.00143 139.9
[M+Na-2H]- 227.98338 145.4
[M]+ 207.00816 141.1
[M]- 207.00926 141.1
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