CID 271283

6-chloroquinoline-2-carbaldehyde

Structural Information

Molecular Formula
C10H6ClNO
SMILES
C1=CC2=C(C=CC(=N2)C=O)C=C1Cl
InChI
InChI=1S/C10H6ClNO/c11-8-2-4-10-7(5-8)1-3-9(6-13)12-10/h1-6H
InChIKey
MDISQESZDBPYRY-UHFFFAOYSA-N
Compound name
6-chloroquinoline-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

76
Patents

191.0138 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.021076 134.6
[M+Na]+ 214.003018 146.1
[M-H]- 190.006524 138.2
[M+NH4]+ 209.047623 155.2
[M+K]+ 229.976958 141.1
[M+H-H2O]+ 174.011060 128.8
[M+HCOO]- 236.012001 153.3
[M+CH3COO]- 250.027651 148.9
[M+Na-2H]- 211.988466 143.8
[M]+ 191.01325142 137.7
[M]- 191.01434858 137.7
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