CID 11816047

6-(dimethylamino)-4-methylnicotinaldehyde

Structural Information

Molecular Formula
C9H12N2O
SMILES
CC1=CC(=NC=C1C=O)N(C)C
InChI
InChI=1S/C9H12N2O/c1-7-4-9(11(2)3)10-5-8(7)6-12/h4-6H,1-3H3
InChIKey
WPSFOIQTQNCLRY-UHFFFAOYSA-N
Compound name
6-(dimethylamino)-4-methylpyridine-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

164.09496 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.10224 133.2
[M+Na]+ 187.08418 142.2
[M-H]- 163.08768 137.6
[M+NH4]+ 182.12878 153.5
[M+K]+ 203.05812 141.4
[M+H-H2O]+ 147.09222 126.6
[M+HCOO]- 209.09316 158.5
[M+CH3COO]- 223.10881 185.7
[M+Na-2H]- 185.06963 139.8
[M]+ 164.09441 135.7
[M]- 164.09551 135.7
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