CID 9589043

Brn 4263398

Structural Information

Molecular Formula
C16H15ClN2O2
SMILES
COC1=CC=C(C=C1)CC(=O)N/N=C/C2=CC=CC=C2Cl
InChI
InChI=1S/C16H15ClN2O2/c1-21-14-8-6-12(7-9-14)10-16(20)19-18-11-13-4-2-3-5-15(13)17/h2-9,11H,10H2,1H3,(H,19,20)/b18-11+
InChIKey
PEWQEXBKAQCQFH-WOJGMQOQSA-N
Compound name
N-[(E)-(2-chlorophenyl)methylideneamino]-2-(4-methoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.0822 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.08948 169.0
[M+Na]+ 325.07142 176.4
[M-H]- 301.07492 176.8
[M+NH4]+ 320.11602 184.9
[M+K]+ 341.04536 171.4
[M+H-H2O]+ 285.07946 161.1
[M+HCOO]- 347.08040 191.5
[M+CH3COO]- 361.09605 208.3
[M+Na-2H]- 323.05687 173.9
[M]+ 302.08165 172.9
[M]- 302.08275 172.9
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.