CID 768038

Picolinic acid (3-indolylmethylene)-hydrazide

Structural Information

Molecular Formula
C15H12N4O
SMILES
C1=CC=C2C(=C1)C(=CN2)C=NNC(=O)C3=CC=CC=N3
InChI
InChI=1S/C15H12N4O/c20-15(14-7-3-4-8-16-14)19-18-10-11-9-17-13-6-2-1-5-12(11)13/h1-10,17H,(H,19,20)
InChIKey
ITHXFUHWMKSSJX-UHFFFAOYSA-N
Compound name
N-(1H-indol-3-ylmethylideneamino)pyridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.1011 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.10838 156.8
[M+Na]+ 287.09032 164.8
[M-H]- 263.09382 162.3
[M+NH4]+ 282.13492 172.5
[M+K]+ 303.06426 159.4
[M+H-H2O]+ 247.09836 147.5
[M+HCOO]- 309.09930 182.0
[M+CH3COO]- 323.11495 168.7
[M+Na-2H]- 285.07577 165.2
[M]+ 264.10055 156.6
[M]- 264.10165 156.6
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.