CID 3849773

[n-[1-[2-(2-pyridylcarboxamido)phenyl]ethylidene]glycinato]nickel

Structural Information

Molecular Formula
C16H15N3O3
SMILES
CC(=NCC(=O)O)C1=CC=CC=C1NC(=O)C2=CC=CC=N2
InChI
InChI=1S/C16H15N3O3/c1-11(18-10-15(20)21)12-6-2-3-7-13(12)19-16(22)14-8-4-5-9-17-14/h2-9H,10H2,1H3,(H,19,22)(H,20,21)
InChIKey
DMABXZXTDBCWBN-UHFFFAOYSA-N
Compound name
2-[1-[2-(pyridine-2-carbonylamino)phenyl]ethylideneamino]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.11133 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.11861 168.1
[M+Na]+ 320.10055 172.8
[M-H]- 296.10405 173.2
[M+NH4]+ 315.14515 180.5
[M+K]+ 336.07449 169.8
[M+H-H2O]+ 280.10859 158.7
[M+HCOO]- 342.10953 190.7
[M+CH3COO]- 356.12518 206.9
[M+Na-2H]- 318.08600 171.8
[M]+ 297.11078 167.4
[M]- 297.11188 167.4
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.