CID 9589053

Brn 4254479

Structural Information

Molecular Formula
C12H15ClN2O2
SMILES
CC(C)(CO)C(=O)N/N=C/C1=CC=CC=C1Cl
InChI
InChI=1S/C12H15ClN2O2/c1-12(2,8-16)11(17)15-14-7-9-5-3-4-6-10(9)13/h3-7,16H,8H2,1-2H3,(H,15,17)/b14-7+
InChIKey
VOFCXEJRTRKHSY-VGOFMYFVSA-N
Compound name
N-[(E)-(2-chlorophenyl)methylideneamino]-3-hydroxy-2,2-dimethylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.0822 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.08948 157.2
[M+Na]+ 277.07142 167.6
[M+NH4]+ 272.11602 164.1
[M+K]+ 293.04536 161.8
[M-H]- 253.07492 158.6
[M+Na-2H]- 275.05687 162.7
[M]+ 254.08165 159.1
[M]- 254.08275 159.1
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.