CID 9653932

2,4-dichloro-n'-(1-(3-(1h-tetraazol-1-yl)phenyl)ethylidene)benzohydrazide

Structural Information

Molecular Formula
C16H12Cl2N6O
SMILES
C/C(=N\NC(=O)C1=C(C=C(C=C1)Cl)Cl)/C2=CC(=CC=C2)N3C=NN=N3
InChI
InChI=1S/C16H12Cl2N6O/c1-10(11-3-2-4-13(7-11)24-9-19-22-23-24)20-21-16(25)14-6-5-12(17)8-15(14)18/h2-9H,1H3,(H,21,25)/b20-10+
InChIKey
RACBJIMNTPULTN-KEBDBYFISA-N
Compound name
2,4-dichloro-N-[(E)-1-[3-(tetrazol-1-yl)phenyl]ethylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

374.04495 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.05223 183.3
[M+Na]+ 397.03417 192.3
[M-H]- 373.03767 188.8
[M+NH4]+ 392.07877 192.6
[M+K]+ 413.00811 185.4
[M+H-H2O]+ 357.04221 171.6
[M+HCOO]- 419.04315 195.7
[M+CH3COO]- 433.05880 192.7
[M+Na-2H]- 395.01962 185.8
[M]+ 374.04440 186.8
[M]- 374.04550 186.8
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.