CID 9646872

2-(3-methoxyphenoxy)-n'-(1-(3-(1h-tetraazol-1-yl)ph)ethylidene)acetohydrazide

Structural Information

Molecular Formula
C18H18N6O3
SMILES
C/C(=N\NC(=O)COC1=CC=CC(=C1)OC)/C2=CC(=CC=C2)N3C=NN=N3
InChI
InChI=1S/C18H18N6O3/c1-13(14-5-3-6-15(9-14)24-12-19-22-23-24)20-21-18(25)11-27-17-8-4-7-16(10-17)26-2/h3-10,12H,11H2,1-2H3,(H,21,25)/b20-13+
InChIKey
RNILDBYCAWPVLS-DEDYPNTBSA-N
Compound name
2-(3-methoxyphenoxy)-N-[(E)-1-[3-(tetrazol-1-yl)phenyl]ethylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.14404 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.15132 183.4
[M+Na]+ 389.13326 189.3
[M-H]- 365.13676 189.6
[M+NH4]+ 384.17786 191.2
[M+K]+ 405.10720 185.7
[M+H-H2O]+ 349.14130 170.8
[M+HCOO]- 411.14224 205.6
[M+CH3COO]- 425.15789 220.4
[M+Na-2H]- 387.11871 187.6
[M]+ 366.14349 186.5
[M]- 366.14459 186.5
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.