CID 468631

Propane, 1,2-diisonicotinoylhydrazono-

Structural Information

Molecular Formula
C16H19N5O2
SMILES
CC(CNNC(=O)C1=CC=NC=C1)NNC(=O)C2=CC=CC=C2
InChI
InChI=1S/C16H19N5O2/c1-12(19-21-16(23)13-5-3-2-4-6-13)11-18-20-15(22)14-7-9-17-10-8-14/h2-10,12,18-19H,11H2,1H3,(H,20,22)(H,21,23)
InChIKey
IZBBTWJSGYYRCC-UHFFFAOYSA-N
Compound name
N'-[2-(2-benzoylhydrazinyl)propyl]pyridine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.15387 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.16115 171.0
[M+Na]+ 336.14309 172.8
[M-H]- 312.14659 175.6
[M+NH4]+ 331.18769 181.8
[M+K]+ 352.11703 170.0
[M+H-H2O]+ 296.15113 160.8
[M+HCOO]- 358.15207 195.3
[M+CH3COO]- 372.16772 215.0
[M+Na-2H]- 334.12854 176.7
[M]+ 313.15332 167.8
[M]- 313.15442 167.8
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.