CID 135770366

Propanimidamide, 2-(((2,4-dihydroxyphenyl)methylene)hydrazono)-n-(4-ethoxyphenyl)-n'-hydroxy-

Structural Information

Molecular Formula
C18H20N4O4
SMILES
CCOC1=CC=C(C=C1)N=C(/C(=N/N=C/C2=C(C=C(C=C2)O)O)/C)NO
InChI
InChI=1S/C18H20N4O4/c1-3-26-16-8-5-14(6-9-16)20-18(22-25)12(2)21-19-11-13-4-7-15(23)10-17(13)24/h4-11,23-25H,3H2,1-2H3,(H,20,22)/b19-11+,21-12+
InChIKey
ORMSTOWCVLQWDK-NDCXBJOESA-N
Compound name
(2E)-2-[(E)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-N'-(4-ethoxyphenyl)-N-hydroxypropanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.14847 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.155746 182.7
[M+Na]+ 379.137688 186.7
[M-H]- 355.141194 189.4
[M+NH4]+ 374.182293 193.9
[M+K]+ 395.111628 184.2
[M+H-H2O]+ 339.145730 173.0
[M+HCOO]- 401.146671 209.0
[M+CH3COO]- 415.162321 223.7
[M+Na-2H]- 377.123136 185.9
[M]+ 356.14792142 183.4
[M]- 356.14901858 183.4
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.