CID 135716907

N'-(3-ethoxy-4-hydroxybenzylidene)-2-iodobenzohydrazide

Structural Information

Molecular Formula
C16H15IN2O3
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=CC=C2I)O
InChI
InChI=1S/C16H15IN2O3/c1-2-22-15-9-11(7-8-14(15)20)10-18-19-16(21)12-5-3-4-6-13(12)17/h3-10,20H,2H2,1H3,(H,19,21)/b18-10+
InChIKey
KDCXFINAWWYPRW-VCHYOVAHSA-N
Compound name
N-[(E)-(3-ethoxy-4-hydroxyphenyl)methylideneamino]-2-iodobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

410.01273 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 411.02001 185.5
[M+Na]+ 433.00195 184.7
[M-H]- 409.00545 184.8
[M+NH4]+ 428.04655 194.9
[M+K]+ 448.97589 187.1
[M+H-H2O]+ 393.00999 173.0
[M+HCOO]- 455.01093 205.2
[M+CH3COO]- 469.02658 215.4
[M+Na-2H]- 430.98740 176.6
[M]+ 410.01218 184.0
[M]- 410.01328 184.0
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.