CID 54688615

4-hydroxy-3-(morpholinocarbonyl)coumarin

Structural Information

Molecular Formula
C14H13NO5
SMILES
C1COCCN1C(=O)C2=C(C3=CC=CC=C3OC2=O)O
InChI
InChI=1S/C14H13NO5/c16-12-9-3-1-2-4-10(9)20-14(18)11(12)13(17)15-5-7-19-8-6-15/h1-4,16H,5-8H2
InChIKey
SVTFTKLBKRZADH-UHFFFAOYSA-N
Compound name
4-hydroxy-3-(morpholine-4-carbonyl)chromen-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.07938 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.08666 158.7
[M+Na]+ 298.06860 172.3
[M+NH4]+ 293.11320 165.5
[M+K]+ 314.04254 167.7
[M-H]- 274.07210 163.7
[M+Na-2H]- 296.05405 163.6
[M]+ 275.07883 161.9
[M]- 275.07993 161.9
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.