CID 212140

P-anisic acid, 3,5-dichloro-, 2-(p-methoxybenzyl)hydrazide monohydrochloride

Structural Information

Molecular Formula
C16H16Cl2N2O3
SMILES
COC1=CC=C(C=C1)CNNC(=O)C2=CC(=C(C(=C2)Cl)OC)Cl
InChI
InChI=1S/C16H16Cl2N2O3/c1-22-12-5-3-10(4-6-12)9-19-20-16(21)11-7-13(17)15(23-2)14(18)8-11/h3-8,19H,9H2,1-2H3,(H,20,21)
InChIKey
JUFOQSKQSVTKBP-UHFFFAOYSA-N
Compound name
3,5-dichloro-4-methoxy-N'-[(4-methoxyphenyl)methyl]benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.0538 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.06108 178.3
[M+Na]+ 377.04302 186.9
[M-H]- 353.04652 184.7
[M+NH4]+ 372.08762 192.4
[M+K]+ 393.01696 181.4
[M+H-H2O]+ 337.05106 171.8
[M+HCOO]- 399.05200 194.2
[M+CH3COO]- 413.06765 216.1
[M+Na-2H]- 375.02847 180.7
[M]+ 354.05325 184.8
[M]- 354.05435 184.8
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.