CID 9589053

Propanoic acid, 2,2-dimethyl-3-hydroxy-, ((2-chlorophenyl)methylene)hydrazide, (e)-

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]+ 255.089476 157.2
[M+Na]+ 277.071418 164.1
[M-H]- 253.074924 160.8
[M+NH4]+ 272.116023 174.7
[M+K]+ 293.045358 160.1
[M+H-H2O]+ 237.079460 151.7
[M+HCOO]- 299.080401 176.6
[M+CH3COO]- 313.096051 197.3
[M+Na-2H]- 275.056866 162.6
[M]+ 254.08165142 159.3
[M]- 254.08274858 159.3
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.