CID 9589064

(e)-3-amino-2-methylpropanoic acid ((2-chlorophenyl)methylene)hydrazide

Structural Information

Molecular Formula
C11H14ClN3O
SMILES
CC(CN)C(=O)N/N=C/C1=CC=CC=C1Cl
InChI
InChI=1S/C11H14ClN3O/c1-8(6-13)11(16)15-14-7-9-4-2-3-5-10(9)12/h2-5,7-8H,6,13H2,1H3,(H,15,16)/b14-7+
InChIKey
ZRVDUBSLBDUELO-VGOFMYFVSA-N
Compound name
3-amino-N-[(E)-(2-chlorophenyl)methylideneamino]-2-methylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.08253 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.08981 154.8
[M+Na]+ 262.07175 161.0
[M-H]- 238.07525 159.1
[M+NH4]+ 257.11635 172.8
[M+K]+ 278.04569 157.4
[M+H-H2O]+ 222.07979 148.5
[M+HCOO]- 284.08073 176.7
[M+CH3COO]- 298.09638 199.7
[M+Na-2H]- 260.05720 158.3
[M]+ 239.08198 155.1
[M]- 239.08308 155.1
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.