CID 9589044

133661-82-2

Structural Information

Molecular Formula
C17H17ClN2O2
SMILES
C/C(=N\NC(=O)CC1=CC=C(C=C1)OC)/C2=CC=CC=C2Cl
InChI
InChI=1S/C17H17ClN2O2/c1-12(15-5-3-4-6-16(15)18)19-20-17(21)11-13-7-9-14(22-2)10-8-13/h3-10H,11H2,1-2H3,(H,20,21)/b19-12+
InChIKey
ZJGPJJFSMMUTSW-XDHOZWIPSA-N
Compound name
N-[(E)-1-(2-chlorophenyl)ethylideneamino]-2-(4-methoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.09787 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.105146 173.7
[M+Na]+ 339.087088 180.4
[M-H]- 315.090594 181.5
[M+NH4]+ 334.131693 189.0
[M+K]+ 355.061028 175.7
[M+H-H2O]+ 299.095130 165.8
[M+HCOO]- 361.096071 194.9
[M+CH3COO]- 375.111721 212.2
[M+Na-2H]- 337.072536 176.9
[M]+ 316.09732142 177.5
[M]- 316.09841858 177.5
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.