CID 14611408

2-((7-methyl-9-(2-morpholinoethoxy)-5-oxo-5h-furo(3,2-g)(1)benzopyran-4-yl)oxy)acetamide

Structural Information

Molecular Formula
C20H22N2O7
SMILES
CC1=CC(=O)C2=C(C3=C(C(=C2O1)OCCN4CCOCC4)OC=C3)OCC(=O)N
InChI
InChI=1S/C20H22N2O7/c1-12-10-14(23)16-17(28-11-15(21)24)13-2-6-26-18(13)20(19(16)29-12)27-9-5-22-3-7-25-8-4-22/h2,6,10H,3-5,7-9,11H2,1H3,(H2,21,24)
InChIKey
BREHNPSQULABAE-UHFFFAOYSA-N
Compound name
2-[7-methyl-9-(2-morpholin-4-ylethoxy)-5-oxofuro[3,2-g]chromen-4-yl]oxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

402.1427 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 403.14998 192.6
[M+Na]+ 425.13192 200.2
[M-H]- 401.13542 201.5
[M+NH4]+ 420.17652 201.1
[M+K]+ 441.10586 200.6
[M+H-H2O]+ 385.13996 183.9
[M+HCOO]- 447.14090 208.8
[M+CH3COO]- 461.15655 225.2
[M+Na-2H]- 423.11737 195.6
[M]+ 402.14215 199.7
[M]- 402.14325 199.7
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.