CID 120297

Fla 21

Structural Information

Molecular Formula
C24H28N2O4
SMILES
CCN(CC)CCCNC(=O)COC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC=CC=C3
InChI
InChI=1S/C24H28N2O4/c1-3-26(4-2)14-8-13-25-24(28)17-29-19-11-12-20-21(27)16-22(30-23(20)15-19)18-9-6-5-7-10-18/h5-7,9-12,15-16H,3-4,8,13-14,17H2,1-2H3,(H,25,28)
InChIKey
INZKDTCOKBTCIH-UHFFFAOYSA-N
Compound name
N-[3-(diethylamino)propyl]-2-(4-oxo-2-phenylchromen-7-yl)oxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

408.2049 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.212176 201.6
[M+Na]+ 431.194118 206.1
[M-H]- 407.197624 210.2
[M+NH4]+ 426.238723 211.5
[M+K]+ 447.168058 203.8
[M+H-H2O]+ 391.202160 190.9
[M+HCOO]- 453.203101 223.8
[M+CH3COO]- 467.218751 233.5
[M+Na-2H]- 429.179566 204.9
[M]+ 408.20435142 207.8
[M]- 408.20544858 207.8
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.