CID 949715

3-(4-((2-chlorobenzyl)oxy)phenyl)-1h-pyrazole-5-carbohydrazide

Structural Information

Molecular Formula
C17H15ClN4O2
SMILES
C1=CC=C(C(=C1)COC2=CC=C(C=C2)C3=NNC(=C3)C(=O)NN)Cl
InChI
InChI=1S/C17H15ClN4O2/c18-14-4-2-1-3-12(14)10-24-13-7-5-11(6-8-13)15-9-16(22-21-15)17(23)20-19/h1-9H,10,19H2,(H,20,23)(H,21,22)
InChIKey
QNKJABKYALCFPG-UHFFFAOYSA-N
Compound name
3-[4-[(2-chlorophenyl)methoxy]phenyl]-1H-pyrazole-5-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.08835 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.09563 178.9
[M+Na]+ 365.07757 191.9
[M+NH4]+ 360.12217 185.4
[M+K]+ 381.05151 186.7
[M-H]- 341.08107 183.7
[M+Na-2H]- 363.06302 187.4
[M]+ 342.08780 182.1
[M]- 342.08890 182.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.