CID 3062115

(e)-(+-)-2-(((2-amino-5-chlorophenyl)phenylmethylene)amino)propanamide

Structural Information

Molecular Formula
C16H16ClN3O
SMILES
CC(C(=O)N)N=C(C1=CC=CC=C1)C2=C(C=CC(=C2)Cl)N
InChI
InChI=1S/C16H16ClN3O/c1-10(16(19)21)20-15(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)18/h2-10H,18H2,1H3,(H2,19,21)
InChIKey
KCUUODSQNIPXQE-UHFFFAOYSA-N
Compound name
2-[[(2-amino-5-chlorophenyl)-phenylmethylidene]amino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.09818 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.10546 170.7
[M+Na]+ 324.08740 182.5
[M+NH4]+ 319.13200 178.3
[M+K]+ 340.06134 175.8
[M-H]- 300.09090 176.1
[M+Na-2H]- 322.07285 178.3
[M]+ 301.09763 174.0
[M]- 301.09873 174.0
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.