CID 138039831

5-chloro-6-methoxy-2,4-dimethylpyridine-3-carbaldehyde

Structural Information

Molecular Formula
C9H10ClNO2
SMILES
CC1=C(C(=NC(=C1Cl)OC)C)C=O
InChI
InChI=1S/C9H10ClNO2/c1-5-7(4-12)6(2)11-9(13-3)8(5)10/h4H,1-3H3
InChIKey
INYUMUASRBPQNV-UHFFFAOYSA-N
Compound name
5-chloro-6-methoxy-2,4-dimethylpyridine-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.04001 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.04729 138.3
[M+Na]+ 222.02923 153.5
[M+NH4]+ 217.07383 146.5
[M+K]+ 238.00317 146.5
[M-H]- 198.03273 139.8
[M+Na-2H]- 220.01468 144.9
[M]+ 199.03946 141.2
[M]- 199.04056 141.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.