CID 13802841

N-(4-chlorobenzylidene)-5-methyl-3-isoxazolamine

Structural Information

Molecular Formula
C11H9ClN2O
SMILES
CC1=CC(=NO1)N=CC2=CC=C(C=C2)Cl
InChI
InChI=1S/C11H9ClN2O/c1-8-6-11(14-15-8)13-7-9-2-4-10(12)5-3-9/h2-7H,1H3
InChIKey
CZIIIUGHTWDINI-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.04034 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.04762 145.4
[M+Na]+ 243.02956 160.6
[M+NH4]+ 238.07416 154.6
[M+K]+ 259.00350 154.4
[M-H]- 219.03306 151.2
[M+Na-2H]- 241.01501 154.4
[M]+ 220.03979 149.6
[M]- 220.04089 149.6
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.