CID 5981202

Benzaldehyde, p-isopropyl-, (5-nitro-2-pyridyl)hydrazone

Structural Information

Molecular Formula
C15H16N4O2
SMILES
CC(C)C1=CC=C(C=C1)/C=N\NC2=NC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C15H16N4O2/c1-11(2)13-5-3-12(4-6-13)9-17-18-15-8-7-14(10-16-15)19(20)21/h3-11H,1-2H3,(H,16,18)/b17-9-
InChIKey
WLOUUOGRUBGLOQ-MFOYZWKCSA-N
Compound name
5-nitro-N-[(Z)-(4-propan-2-ylphenyl)methylideneamino]pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.12732 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.134596 163.9
[M+Na]+ 307.116538 168.9
[M-H]- 283.120044 170.5
[M+NH4]+ 302.161143 177.1
[M+K]+ 323.090478 161.6
[M+H-H2O]+ 267.124580 158.9
[M+HCOO]- 329.125521 190.3
[M+CH3COO]- 343.141171 202.8
[M+Na-2H]- 305.101986 171.4
[M]+ 284.12677142 162.2
[M]- 284.12786858 162.2
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.