CID 135538376

Benzaldehyde, 3-ethoxy-4-hydroxy-, (5-nitro-2-pyridyl)hydrazone

Structural Information

Molecular Formula
C14H14N4O4
SMILES
CCOC1=C(C=CC(=C1)/C=N\NC2=NC=C(C=C2)[N+](=O)[O-])O
InChI
InChI=1S/C14H14N4O4/c1-2-22-13-7-10(3-5-12(13)19)8-16-17-14-6-4-11(9-15-14)18(20)21/h3-9,19H,2H2,1H3,(H,15,17)/b16-8-
InChIKey
GTXRHJCARPJGTL-PXNMLYILSA-N
Compound name
2-ethoxy-4-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.1015 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.108776 164.7
[M+Na]+ 325.090718 170.4
[M-H]- 301.094224 170.4
[M+NH4]+ 320.135323 176.6
[M+K]+ 341.064658 163.2
[M+H-H2O]+ 285.098760 159.7
[M+HCOO]- 347.099701 191.2
[M+CH3COO]- 361.115351 202.0
[M+Na-2H]- 323.076166 173.2
[M]+ 302.10095142 164.5
[M]- 302.10204858 164.5
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.