CID 3040346

K 8149

Structural Information

Molecular Formula
C20H22N2O3
SMILES
CN(C)C1=C(C(=O)C2=C(O1)C=CC3=CC=CC=C32)CN4CCOCC4
InChI
InChI=1S/C20H22N2O3/c1-21(2)20-16(13-22-9-11-24-12-10-22)19(23)18-15-6-4-3-5-14(15)7-8-17(18)25-20/h3-8H,9-13H2,1-2H3
InChIKey
UBESFGQJLIQQHR-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-2-(morpholin-4-ylmethyl)benzo[f]chromen-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.16306 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.170336 180.5
[M+Na]+ 361.152278 188.3
[M-H]- 337.155784 189.9
[M+NH4]+ 356.196883 192.1
[M+K]+ 377.126218 186.5
[M+H-H2O]+ 321.160320 169.9
[M+HCOO]- 383.161261 198.1
[M+CH3COO]- 397.176911 191.3
[M+Na-2H]- 359.137726 187.1
[M]+ 338.16251142 183.2
[M]- 338.16360858 183.2
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.