CID 54688615

19225-07-1

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]+ 276.086656 158.4
[M+Na]+ 298.068598 165.9
[M-H]- 274.072104 164.7
[M+NH4]+ 293.113203 170.5
[M+K]+ 314.042538 165.2
[M+H-H2O]+ 258.076640 150.1
[M+HCOO]- 320.077581 173.9
[M+CH3COO]- 334.093231 194.5
[M+Na-2H]- 296.054046 164.4
[M]+ 275.07883142 158.2
[M]- 275.07992858 158.2
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.