CID 212164

Benzoic acid, 3,5-dichloro-4-methoxy-, 2-butylhydrazide, monohydrochloride

Structural Information

Molecular Formula
C12H16Cl2N2O2
SMILES
CCCCNNC(=O)C1=CC(=C(C(=C1)Cl)OC)Cl
InChI
InChI=1S/C12H16Cl2N2O2/c1-3-4-5-15-16-12(17)8-6-9(13)11(18-2)10(14)7-8/h6-7,15H,3-5H2,1-2H3,(H,16,17)
InChIKey
PHZZBFIGMUAFDS-UHFFFAOYSA-N
Compound name
N'-butyl-3,5-dichloro-4-methoxybenzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.05887 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.066146 163.8
[M+Na]+ 313.048088 172.1
[M-H]- 289.051594 167.0
[M+NH4]+ 308.092693 180.7
[M+K]+ 329.022028 166.9
[M+H-H2O]+ 273.056130 159.0
[M+HCOO]- 335.057071 179.4
[M+CH3COO]- 349.072721 205.2
[M+Na-2H]- 311.033536 166.3
[M]+ 290.05832142 169.0
[M]- 290.05941858 169.0
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.