CID 10467730

4-((1-oxo-1h-2-benzopyran-4-yl)carbonyl)morpholine

Structural Information

Molecular Formula
C14H13NO4
SMILES
C1COCCN1C(=O)C2=COC(=O)C3=CC=CC=C32
InChI
InChI=1S/C14H13NO4/c16-13(15-5-7-18-8-6-15)12-9-19-14(17)11-4-2-1-3-10(11)12/h1-4,9H,5-8H2
InChIKey
KVIHJKUVSAAHPO-UHFFFAOYSA-N
Compound name
4-(morpholine-4-carbonyl)isochromen-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.08447 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.09175 155.2
[M+Na]+ 282.07369 169.5
[M+NH4]+ 277.11829 163.0
[M+K]+ 298.04763 163.8
[M-H]- 258.07719 161.2
[M+Na-2H]- 280.05914 161.4
[M]+ 259.08392 158.9
[M]- 259.08502 158.9
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.