CID 9589044

Brn 4263835

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]+ 317.10515 173.7
[M+Na]+ 339.08709 180.4
[M-H]- 315.09059 181.5
[M+NH4]+ 334.13169 189.0
[M+K]+ 355.06103 175.7
[M+H-H2O]+ 299.09513 165.8
[M+HCOO]- 361.09607 194.9
[M+CH3COO]- 375.11172 212.2
[M+Na-2H]- 337.07254 176.9
[M]+ 316.09732 177.5
[M]- 316.09842 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.