CID 5762438

4-aminobenzoic (2,3-dimethoxybenzylidene)hydrazide

Structural Information

Molecular Formula
C16H17N3O3
SMILES
COC1=CC=CC(=C1OC)/C=N/NC(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C16H17N3O3/c1-21-14-5-3-4-12(15(14)22-2)10-18-19-16(20)11-6-8-13(17)9-7-11/h3-10H,17H2,1-2H3,(H,19,20)/b18-10+
InChIKey
JVOQLWJCBJKTQN-VCHYOVAHSA-N
Compound name
4-amino-N-[(E)-(2,3-dimethoxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.12698 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.134256 168.6
[M+Na]+ 322.116198 175.0
[M-H]- 298.119704 176.5
[M+NH4]+ 317.160803 183.2
[M+K]+ 338.090138 172.4
[M+H-H2O]+ 282.124240 159.5
[M+HCOO]- 344.125181 196.2
[M+CH3COO]- 358.140831 212.8
[M+Na-2H]- 320.101646 172.8
[M]+ 299.12643142 170.3
[M]- 299.12752858 170.3
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.