CID 135419887

2-(4-chlorophenoxy)-n'-(3-ethoxy-4-hydroxybenzylidene)acetohydrazide

Structural Information

Molecular Formula
C17H17ClN2O4
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)COC2=CC=C(C=C2)Cl)O
InChI
InChI=1S/C17H17ClN2O4/c1-2-23-16-9-12(3-8-15(16)21)10-19-20-17(22)11-24-14-6-4-13(18)5-7-14/h3-10,21H,2,11H2,1H3,(H,20,22)/b19-10+
InChIKey
DCPDTGASPUZIKC-VXLYETTFSA-N
Compound name
2-(4-chlorophenoxy)-N-[(E)-(3-ethoxy-4-hydroxyphenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.08768 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.09496 178.5
[M+Na]+ 371.07690 185.6
[M-H]- 347.08040 185.2
[M+NH4]+ 366.12150 191.9
[M+K]+ 387.05084 181.1
[M+H-H2O]+ 331.08494 170.6
[M+HCOO]- 393.08588 199.6
[M+CH3COO]- 407.10153 214.5
[M+Na-2H]- 369.06235 182.0
[M]+ 348.08713 184.2
[M]- 348.08823 184.2
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.