CID 37923

8-(dimethylaminomethyl)-3-ethyl-7-methoxyflavone hydrochloride

Structural Information

Molecular Formula
C21H23NO3
SMILES
CCC1=C(OC2=C(C1=O)C=CC(=C2CN(C)C)OC)C3=CC=CC=C3
InChI
InChI=1S/C21H23NO3/c1-5-15-19(23)16-11-12-18(24-4)17(13-22(2)3)21(16)25-20(15)14-9-7-6-8-10-14/h6-12H,5,13H2,1-4H3
InChIKey
HLICTKPAIIKLGJ-UHFFFAOYSA-N
Compound name
8-[(dimethylamino)methyl]-3-ethyl-7-methoxy-2-phenylchromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.1678 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.17508 180.5
[M+Na]+ 360.15702 196.8
[M+NH4]+ 355.20162 188.9
[M+K]+ 376.13096 188.4
[M-H]- 336.16052 188.0
[M+Na-2H]- 358.14247 188.6
[M]+ 337.16725 185.2
[M]- 337.16835 185.2
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.