CID 25596

13012-71-0

Structural Information

Molecular Formula
C15H17N3O
SMILES
C1=CC=C(C=C1)CCCNNC(=O)C2=CC=NC=C2
InChI
InChI=1S/C15H17N3O/c19-15(14-8-11-16-12-9-14)18-17-10-4-7-13-5-2-1-3-6-13/h1-3,5-6,8-9,11-12,17H,4,7,10H2,(H,18,19)
InChIKey
AOEACXXCOFFKKF-UHFFFAOYSA-N
Compound name
N'-(3-phenylpropyl)pyridine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

255.13716 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.14444 158.2
[M+Na]+ 278.12638 162.6
[M-H]- 254.12988 162.8
[M+NH4]+ 273.17098 172.5
[M+K]+ 294.10032 158.6
[M+H-H2O]+ 238.13442 148.9
[M+HCOO]- 300.13536 182.4
[M+CH3COO]- 314.15101 198.9
[M+Na-2H]- 276.11183 165.6
[M]+ 255.13661 156.7
[M]- 255.13771 156.7
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

patents stripe