CID 9670289

Acetic (2-chloro-4-dimethylaminobenzylidene)hydrazide

Structural Information

Molecular Formula
C11H14ClN3O
SMILES
CC(=O)N/N=C/C1=C(C=C(C=C1)N(C)C)Cl
InChI
InChI=1S/C11H14ClN3O/c1-8(16)14-13-7-9-4-5-10(15(2)3)6-11(9)12/h4-7H,1-3H3,(H,14,16)/b13-7+
InChIKey
BWALCIPZJYYMDM-NTUHNPAUSA-N
Compound name
N-[(E)-[2-chloro-4-(dimethylamino)phenyl]methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.08253 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.089806 154.2
[M+Na]+ 262.071748 161.8
[M-H]- 238.075254 160.8
[M+NH4]+ 257.116353 173.5
[M+K]+ 278.045688 159.4
[M+H-H2O]+ 222.079790 147.9
[M+HCOO]- 284.080731 178.2
[M+CH3COO]- 298.096381 204.0
[M+Na-2H]- 260.057196 158.6
[M]+ 239.08198142 157.8
[M]- 239.08307858 157.8
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.