CID 3073399

1h-2-benzopyran-4-carboxamide, n,n-di-2-propenyl-4-oxo-

Structural Information

Molecular Formula
C16H15NO3
SMILES
C=CCN(CC=C)C(=O)C1=COC(=O)C2=CC=CC=C21
InChI
InChI=1S/C16H15NO3/c1-3-9-17(10-4-2)15(18)14-11-20-16(19)13-8-6-5-7-12(13)14/h3-8,11H,1-2,9-10H2
InChIKey
LXGVTJPNTMTBHX-UHFFFAOYSA-N
Compound name
1-oxo-N,N-bis(prop-2-enyl)isochromene-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.1052 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.11248 160.2
[M+Na]+ 292.09442 173.2
[M+NH4]+ 287.13902 167.3
[M+K]+ 308.06836 166.6
[M-H]- 268.09792 163.9
[M+Na-2H]- 290.07987 165.6
[M]+ 269.10465 163.0
[M]- 269.10575 163.0
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.