CID 9577272

N-(2-pyridone-6-yl)-n',n'-di-n-propylformamidine

Structural Information

Molecular Formula
C12H19N3O
SMILES
CCCN(CCC)/C=N/C1=CC=CC(=O)N1
InChI
InChI=1S/C12H19N3O/c1-3-8-15(9-4-2)10-13-11-6-5-7-12(16)14-11/h5-7,10H,3-4,8-9H2,1-2H3,(H,14,16)/b13-10+
InChIKey
MEYPAYJYAZKERR-JLHYYAGUSA-N
Compound name
N'-(6-oxo-1H-pyridin-2-yl)-N,N-dipropylmethanimidamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

14
References

126
Patents

221.15282 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.160096 151.3
[M+Na]+ 244.142038 157.3
[M-H]- 220.145544 154.5
[M+NH4]+ 239.186643 168.5
[M+K]+ 260.115978 155.1
[M+H-H2O]+ 204.150080 143.2
[M+HCOO]- 266.151021 176.7
[M+CH3COO]- 280.166671 197.1
[M+Na-2H]- 242.127486 157.1
[M]+ 221.15227142 152.8
[M]- 221.15336858 152.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.