CID 9589052

Propanoic acid, 2,2-dimethyl-3-hydroxy-, (1-(2-chlorophenyl)ethylidene)hydrazide, (e)-

Structural Information

Molecular Formula
C13H17ClN2O2
SMILES
C/C(=N\NC(=O)C(C)(C)CO)/C1=CC=CC=C1Cl
InChI
InChI=1S/C13H17ClN2O2/c1-9(10-6-4-5-7-11(10)14)15-16-12(18)13(2,3)8-17/h4-7,17H,8H2,1-3H3,(H,16,18)/b15-9+
InChIKey
NATCGIMQOYQIAT-OQLLNIDSSA-N
Compound name
N-[(E)-1-(2-chlorophenyl)ethylideneamino]-3-hydroxy-2,2-dimethylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.09787 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.105146 161.5
[M+Na]+ 291.087088 167.8
[M-H]- 267.090594 165.1
[M+NH4]+ 286.131693 178.4
[M+K]+ 307.061028 164.1
[M+H-H2O]+ 251.095130 156.1
[M+HCOO]- 313.096071 179.6
[M+CH3COO]- 327.111721 201.2
[M+Na-2H]- 289.072536 165.3
[M]+ 268.09732142 163.5
[M]- 268.09841858 163.5
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.