CID 9631159

2((2,4-di-cl-phenoxy)me)n'-(1-(3-(1h-tetraazol-1-yl)ph)ethylidene)benzohydrazide

Structural Information

Molecular Formula
C23H18Cl2N6O2
SMILES
C/C(=N\NC(=O)C1=CC=CC=C1COC2=C(C=C(C=C2)Cl)Cl)/C3=CC(=CC=C3)N4C=NN=N4
InChI
InChI=1S/C23H18Cl2N6O2/c1-15(16-6-4-7-19(11-16)31-14-26-29-30-31)27-28-23(32)20-8-3-2-5-17(20)13-33-22-10-9-18(24)12-21(22)25/h2-12,14H,13H2,1H3,(H,28,32)/b27-15+
InChIKey
UAYWFEWSFZEYMR-JFLMPSFJSA-N
Compound name
2-[(2,4-dichlorophenoxy)methyl]-N-[(E)-1-[3-(tetrazol-1-yl)phenyl]ethylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

480.08682 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 481.09410 209.7
[M+Na]+ 503.07604 217.3
[M-H]- 479.07954 218.0
[M+NH4]+ 498.12064 214.2
[M+K]+ 519.04998 209.5
[M+H-H2O]+ 463.08408 196.0
[M+HCOO]- 525.08502 221.0
[M+CH3COO]- 539.10067 217.1
[M+Na-2H]- 501.06149 210.7
[M]+ 480.08627 215.0
[M]- 480.08737 215.0
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.