CID 5829341

Dtxsid00429616

Structural Information

Molecular Formula
C14H15N3O
SMILES
C1C2CC(C1C=C2)/C=N\NC(=O)C3=CC=NC=C3
InChI
InChI=1S/C14H15N3O/c18-14(11-3-5-15-6-4-11)17-16-9-13-8-10-1-2-12(13)7-10/h1-6,9-10,12-13H,7-8H2,(H,17,18)/b16-9-
InChIKey
VUCKSEXZWPSNKP-SXGWCWSVSA-N
Compound name
N-[(Z)-2-bicyclo[2.2.1]hept-5-enylmethylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.1215 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.12878 153.2
[M+Na]+ 264.11072 159.2
[M-H]- 240.11422 159.3
[M+NH4]+ 259.15532 174.3
[M+K]+ 280.08466 156.1
[M+H-H2O]+ 224.11876 145.6
[M+HCOO]- 286.11970 177.9
[M+CH3COO]- 300.13535 165.6
[M+Na-2H]- 262.09617 157.8
[M]+ 241.12095 152.5
[M]- 241.12205 152.5
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.