CID 9610818

5-chloro-2-methoxy-n'-(1-(4-(1h-tetraazol-1-yl)phenyl)ethylidene)benzohydrazide

Structural Information

Molecular Formula
C17H15ClN6O2
SMILES
C/C(=N\NC(=O)C1=C(C=CC(=C1)Cl)OC)/C2=CC=C(C=C2)N3C=NN=N3
InChI
InChI=1S/C17H15ClN6O2/c1-11(12-3-6-14(7-4-12)24-10-19-22-23-24)20-21-17(25)15-9-13(18)5-8-16(15)26-2/h3-10H,1-2H3,(H,21,25)/b20-11+
InChIKey
HBSYTYHQCAPQSS-RGVLZGJSSA-N
Compound name
5-chloro-2-methoxy-N-[(E)-1-[4-(tetrazol-1-yl)phenyl]ethylideneamino]benzamide
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 184.2
[M+Na]+ 393.08372 192.5
[M-H]- 369.08722 190.7
[M+NH4]+ 388.12832 193.2
[M+K]+ 409.05766 186.9
[M+H-H2O]+ 353.09176 172.3
[M+HCOO]- 415.09270 201.9
[M+CH3COO]- 429.10835 220.0
[M+Na-2H]- 391.06917 187.4
[M]+ 370.09395 188.3
[M]- 370.09505 188.3
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.