CID 9664817

767302-17-0

Structural Information

Molecular Formula
C26H35ClN2O2
SMILES
CCCCCCCCCCCC(=O)N/N=C/C1=CC=C(C=C1)OCC2=CC=C(C=C2)Cl
InChI
InChI=1S/C26H35ClN2O2/c1-2-3-4-5-6-7-8-9-10-11-26(30)29-28-20-22-14-18-25(19-15-22)31-21-23-12-16-24(27)17-13-23/h12-20H,2-11,21H2,1H3,(H,29,30)/b28-20+
InChIKey
XGEYQQRMJWBNFA-VFCFBJKWSA-N
Compound name
N-[(E)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]dodecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

442.2387 Da
Monoisotopic Mass

8.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 443.24598 214.1
[M+Na]+ 465.22792 217.0
[M-H]- 441.23142 219.9
[M+NH4]+ 460.27252 224.1
[M+K]+ 481.20186 209.7
[M+H-H2O]+ 425.23596 204.0
[M+HCOO]- 487.23690 233.1
[M+CH3COO]- 501.25255 237.8
[M+Na-2H]- 463.21337 213.6
[M]+ 442.23815 221.5
[M]- 442.23925 221.5
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.