CID 80637999

6-[methyl(propan-2-yl)amino]pyridine-3-carbaldehyde

Structural Information

Molecular Formula
C10H14N2O
SMILES
CC(C)N(C)C1=NC=C(C=C1)C=O
InChI
InChI=1S/C10H14N2O/c1-8(2)12(3)10-5-4-9(7-13)6-11-10/h4-8H,1-3H3
InChIKey
CJLQSWWRTYKQQH-UHFFFAOYSA-N
Compound name
6-[methyl(propan-2-yl)amino]pyridine-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.11061 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.11789 138.6
[M+Na]+ 201.09983 145.9
[M-H]- 177.10333 142.4
[M+NH4]+ 196.14443 157.9
[M+K]+ 217.07377 145.4
[M+H-H2O]+ 161.10787 131.5
[M+HCOO]- 223.10881 162.6
[M+CH3COO]- 237.12446 188.4
[M+Na-2H]- 199.08528 144.1
[M]+ 178.11006 140.4
[M]- 178.11116 140.4
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.