CID 3022120

Brn 4449100

Structural Information

Molecular Formula
C14H14N2O2
SMILES
CC1=C(C=CC=N1)C(=O)NC2=CC=C(C=C2)OC
InChI
InChI=1S/C14H14N2O2/c1-10-13(4-3-9-15-10)14(17)16-11-5-7-12(18-2)8-6-11/h3-9H,1-2H3,(H,16,17)
InChIKey
RGXHBALUGGGRDL-UHFFFAOYSA-N
Compound name
N-(4-methoxyphenyl)-2-methylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.10553 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.112806 154.0
[M+Na]+ 265.094748 161.6
[M-H]- 241.098254 159.7
[M+NH4]+ 260.139353 169.8
[M+K]+ 281.068688 158.5
[M+H-H2O]+ 225.102790 145.6
[M+HCOO]- 287.103731 177.8
[M+CH3COO]- 301.119381 195.3
[M+Na-2H]- 263.080196 159.9
[M]+ 242.10498142 155.1
[M]- 242.10607858 155.1
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.