CID 45054504

395086-92-7

Structural Information

Molecular Formula
C19H15ClN2O3
SMILES
C1=COC(=C1)/C=N/NC(=O)C2=CC=C(C=C2)OCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C19H15ClN2O3/c20-16-7-3-14(4-8-16)13-25-17-9-5-15(6-10-17)19(23)22-21-12-18-2-1-11-24-18/h1-12H,13H2,(H,22,23)/b21-12+
InChIKey
BUXYASWFANMBNQ-CIAFOILYSA-N
Compound name
4-[(4-chlorophenyl)methoxy]-N-[(E)-furan-2-ylmethylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.07712 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.08440 183.9
[M+Na]+ 377.06634 191.1
[M-H]- 353.06984 195.6
[M+NH4]+ 372.11094 197.6
[M+K]+ 393.04028 186.7
[M+H-H2O]+ 337.07438 175.1
[M+HCOO]- 399.07532 206.6
[M+CH3COO]- 413.09097 215.3
[M+Na-2H]- 375.05179 187.8
[M]+ 354.07657 189.2
[M]- 354.07767 189.2
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.