CID 135479858

N'-(2-hydroxy-3-methoxybenzylidene)-2-iodobenzohydrazide

Structural Information

Molecular Formula
C15H13IN2O3
SMILES
COC1=CC=CC(=C1O)/C=N/NC(=O)C2=CC=CC=C2I
InChI
InChI=1S/C15H13IN2O3/c1-21-13-8-4-5-10(14(13)19)9-17-18-15(20)11-6-2-3-7-12(11)16/h2-9,19H,1H3,(H,18,20)/b17-9+
InChIKey
AGTMWGRORQLIOQ-RQZCQDPDSA-N
Compound name
N-[(E)-(2-hydroxy-3-methoxyphenyl)methylideneamino]-2-iodobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

395.9971 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.00438 180.7
[M+Na]+ 418.98632 180.4
[M-H]- 394.98982 180.2
[M+NH4]+ 414.03092 190.6
[M+K]+ 434.96026 182.9
[M+H-H2O]+ 378.99436 168.4
[M+HCOO]- 440.99530 200.7
[M+CH3COO]- 455.01095 212.6
[M+Na-2H]- 416.97177 172.4
[M]+ 395.99655 178.9
[M]- 395.99765 178.9
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

patents stripe