CID 9620494

2-(4-chlorophenoxy)-n'-(1-(4-(1h-tetraazol-1-yl)phenyl)ethylidene)acetohydrazide

Structural Information

Molecular Formula
C17H15ClN6O2
SMILES
C/C(=N\NC(=O)COC1=CC=C(C=C1)Cl)/C2=CC=C(C=C2)N3C=NN=N3
InChI
InChI=1S/C17H15ClN6O2/c1-12(13-2-6-15(7-3-13)24-11-19-22-23-24)20-21-17(25)10-26-16-8-4-14(18)5-9-16/h2-9,11H,10H2,1H3,(H,21,25)/b20-12+
InChIKey
VSEIUMRRAIKLPD-UDWIEESQSA-N
Compound name
2-(4-chlorophenoxy)-N-[(E)-1-[4-(tetrazol-1-yl)phenyl]ethylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.0945 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.10178 183.1
[M+Na]+ 393.08372 190.4
[M-H]- 369.08722 189.1
[M+NH4]+ 388.12832 191.7
[M+K]+ 409.05766 184.8
[M+H-H2O]+ 353.09176 170.8
[M+HCOO]- 415.09270 200.7
[M+CH3COO]- 429.10835 218.8
[M+Na-2H]- 391.06917 187.1
[M]+ 370.09395 186.7
[M]- 370.09505 186.7
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.