CID 9578543

Benzoic acid, 3,5-dichloro-4-methoxy-, 2-propylidenehydrazide

Structural Information

Molecular Formula
C11H12Cl2N2O2
SMILES
CC/C=N/NC(=O)C1=CC(=C(C(=C1)Cl)OC)Cl
InChI
InChI=1S/C11H12Cl2N2O2/c1-3-4-14-15-11(16)7-5-8(12)10(17-2)9(13)6-7/h4-6H,3H2,1-2H3,(H,15,16)/b14-4+
InChIKey
MLQZYPIWLLJHEF-LNKIKWGQSA-N
Compound name
3,5-dichloro-4-methoxy-N-[(E)-propylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.0276 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.034876 158.4
[M+Na]+ 297.016818 167.9
[M-H]- 273.020324 163.2
[M+NH4]+ 292.061423 176.7
[M+K]+ 312.990758 163.2
[M+H-H2O]+ 257.024860 153.6
[M+HCOO]- 319.025801 176.0
[M+CH3COO]- 333.041451 203.2
[M+Na-2H]- 295.002266 161.8
[M]+ 274.02705142 164.4
[M]- 274.02814858 164.4
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.