CID 135511229

[[(2e)-2-[(e)-(4-hydroxyphenyl)methylenehydrazono]ethyl]amino] pyridine-3-carboxylate

Structural Information

Molecular Formula
C15H14N4O3
SMILES
C1=CC(=CN=C1)C(=O)ONC/C=N/N=C/C2=CC=C(C=C2)O
InChI
InChI=1S/C15H14N4O3/c20-14-5-3-12(4-6-14)10-18-17-8-9-19-22-15(21)13-2-1-7-16-11-13/h1-8,10-11,19-20H,9H2/b17-8+,18-10+
InChIKey
JGTRKKNZGAXLGG-SSPCNXNLSA-N
Compound name
[[(2E)-2-[(E)-(4-hydroxyphenyl)methylidenehydrazinylidene]ethyl]amino] pyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.1066 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.11388 165.7
[M+Na]+ 321.09582 171.0
[M-H]- 297.09932 172.1
[M+NH4]+ 316.14042 178.6
[M+K]+ 337.06976 167.9
[M+H-H2O]+ 281.10386 155.5
[M+HCOO]- 343.10480 193.2
[M+CH3COO]- 357.12045 209.1
[M+Na-2H]- 319.08127 173.4
[M]+ 298.10605 166.9
[M]- 298.10715 166.9
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

No patent data available for this compound.