CID 1711975

(e)-n-(2-(furanyl)-1-(4-morpholinylcarbonyl)ethenyl)benzamide

Structural Information

Molecular Formula
C18H18N2O4
SMILES
C1COCCN1C(=O)/C(=C\C2=CC=CO2)/NC(=O)C3=CC=CC=C3
InChI
InChI=1S/C18H18N2O4/c21-17(14-5-2-1-3-6-14)19-16(13-15-7-4-10-24-15)18(22)20-8-11-23-12-9-20/h1-7,10,13H,8-9,11-12H2,(H,19,21)/b16-13+
InChIKey
QXVAJZPBNHIOOY-DTQAZKPQSA-N
Compound name
N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.12665 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.13393 177.1
[M+Na]+ 349.11587 179.2
[M-H]- 325.11937 185.4
[M+NH4]+ 344.16047 186.9
[M+K]+ 365.08981 178.3
[M+H-H2O]+ 309.12391 167.8
[M+HCOO]- 371.12485 194.1
[M+CH3COO]- 385.14050 205.6
[M+Na-2H]- 347.10132 178.1
[M]+ 326.12610 173.9
[M]- 326.12720 173.9
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.