CID 736837

N-(3-formyl-2-pyridinyl)-2,2-dimethylpropanamide

Structural Information

Molecular Formula
C11H14N2O2
SMILES
CC(C)(C)C(=O)NC1=C(C=CC=N1)C=O
InChI
InChI=1S/C11H14N2O2/c1-11(2,3)10(15)13-9-8(7-14)5-4-6-12-9/h4-7H,1-3H3,(H,12,13,15)
InChIKey
ANABHCSYKASRRW-UHFFFAOYSA-N
Compound name
N-(3-formylpyridin-2-yl)-2,2-dimethylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

180
Patents

206.10553 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.11281 145.9
[M+Na]+ 229.09475 153.4
[M-H]- 205.09825 148.5
[M+NH4]+ 224.13935 163.6
[M+K]+ 245.06869 151.6
[M+H-H2O]+ 189.10279 139.4
[M+HCOO]- 251.10373 167.9
[M+CH3COO]- 265.11938 188.1
[M+Na-2H]- 227.08020 152.3
[M]+ 206.10498 146.9
[M]- 206.10608 146.9
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