CID 155973338

2,6-dichloro-5-methylpyridine-3-carbaldehyde

Structural Information

Molecular Formula
C7H5Cl2NO
SMILES
CC1=CC(=C(N=C1Cl)Cl)C=O
InChI
InChI=1S/C7H5Cl2NO/c1-4-2-5(3-11)7(9)10-6(4)8/h2-3H,1H3
InChIKey
YLIKBMRDEOSSMN-UHFFFAOYSA-N
Compound name
2,6-dichloro-5-methylpyridine-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.97482 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.98210 132.3
[M+Na]+ 211.96404 148.3
[M+NH4]+ 207.00864 141.4
[M+K]+ 227.93798 140.5
[M-H]- 187.96754 134.1
[M+Na-2H]- 209.94949 140.0
[M]+ 188.97427 135.8
[M]- 188.97537 135.8
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.