CID 9589064

Propanoic acid, 3-amino-2-methyl-, ((2-chlorophenyl)methylene)hydrazide, (e)-

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]+ 240.089806 154.8
[M+Na]+ 262.071748 161.0
[M-H]- 238.075254 159.1
[M+NH4]+ 257.116353 172.8
[M+K]+ 278.045688 157.4
[M+H-H2O]+ 222.079790 148.5
[M+HCOO]- 284.080731 176.7
[M+CH3COO]- 298.096381 199.7
[M+Na-2H]- 260.057196 158.3
[M]+ 239.08198142 155.1
[M]- 239.08307858 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.