CID 5402004

341982-43-2

Structural Information

Molecular Formula
C16H17N3O
SMILES
CC(C)C1=CC=C(C=C1)/C=N\NC(=O)C2=CC=CC=N2
InChI
InChI=1S/C16H17N3O/c1-12(2)14-8-6-13(7-9-14)11-18-19-16(20)15-5-3-4-10-17-15/h3-12H,1-2H3,(H,19,20)/b18-11-
InChIKey
WFJIMRAEOLALEO-WQRHYEAKSA-N
Compound name
N-[(Z)-(4-propan-2-ylphenyl)methylideneamino]pyridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

267.13718 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.14446 163.6
[M+Na]+ 290.12640 176.2
[M+NH4]+ 285.17100 171.1
[M+K]+ 306.10034 168.9
[M-H]- 266.12990 168.4
[M+Na-2H]- 288.11185 172.7
[M]+ 267.13663 166.6
[M]- 267.13773 166.6
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.