CID 11816047

764651-69-6

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

12
Patents

164.09496 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.102236 133.2
[M+Na]+ 187.084178 142.2
[M-H]- 163.087684 137.6
[M+NH4]+ 182.128783 153.5
[M+K]+ 203.058118 141.4
[M+H-H2O]+ 147.092220 126.6
[M+HCOO]- 209.093161 158.5
[M+CH3COO]- 223.108811 185.7
[M+Na-2H]- 185.069626 139.8
[M]+ 164.09441142 135.7
[M]- 164.09550858 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