CID 135599775

Brn 4209491

Structural Information

Molecular Formula
C19H22N4O3
SMILES
CC1=CC=C(C=C1)N=C(/C(=N/N=C/C2=C(C=C(C=C2)OC)OC)/C)NO
InChI
InChI=1S/C19H22N4O3/c1-13-5-8-16(9-6-13)21-19(23-24)14(2)22-20-12-15-7-10-17(25-3)11-18(15)26-4/h5-12,24H,1-4H3,(H,21,23)/b20-12+,22-14+
InChIKey
FGZZLBCJYILYNM-DWHBXHIASA-N
Compound name
(2E)-2-[(E)-(2,4-dimethoxyphenyl)methylidenehydrazinylidene]-N-hydroxy-N'-(4-methylphenyl)propanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.1692 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.17648 185.2
[M+Na]+ 377.15842 189.9
[M-H]- 353.16192 194.5
[M+NH4]+ 372.20302 198.1
[M+K]+ 393.13236 188.0
[M+H-H2O]+ 337.16646 175.0
[M+HCOO]- 399.16740 214.0
[M+CH3COO]- 413.18305 228.8
[M+Na-2H]- 375.14387 188.6
[M]+ 354.16865 188.6
[M]- 354.16975 188.6
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.