CID 14611408

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

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]+ 403.149976 192.6
[M+Na]+ 425.131918 200.2
[M-H]- 401.135424 201.5
[M+NH4]+ 420.176523 201.1
[M+K]+ 441.105858 200.6
[M+H-H2O]+ 385.139960 183.9
[M+HCOO]- 447.140901 208.8
[M+CH3COO]- 461.156551 225.2
[M+Na-2H]- 423.117366 195.6
[M]+ 402.14215142 199.7
[M]- 402.14324858 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.