CID 1576404

N-(4-butoxyphenyl)-2-oxo-2h-chromene-3-carboxamide

Structural Information

Molecular Formula
C20H19NO4
SMILES
CCCCOC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3OC2=O
InChI
InChI=1S/C20H19NO4/c1-2-3-12-24-16-10-8-15(9-11-16)21-19(22)17-13-14-6-4-5-7-18(14)25-20(17)23/h4-11,13H,2-3,12H2,1H3,(H,21,22)
InChIKey
IDEFIQSEBJFWCA-UHFFFAOYSA-N
Compound name
N-(4-butoxyphenyl)-2-oxochromene-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.1314 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.13868 178.8
[M+Na]+ 360.12062 186.1
[M-H]- 336.12412 187.1
[M+NH4]+ 355.16522 191.5
[M+K]+ 376.09456 183.1
[M+H-H2O]+ 320.12866 169.6
[M+HCOO]- 382.12960 201.1
[M+CH3COO]- 396.14525 213.4
[M+Na-2H]- 358.10607 184.6
[M]+ 337.13085 183.3
[M]- 337.13195 183.3
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.