CID 516462

5-ethyl-7-isopropyl-1,2-dimethoxy-11h-indeno[1,2-b]quinolin-10-one

Structural Information

Molecular Formula
C23H25NO3
SMILES
CCN1C2=C(C=CC(=C2)C(C)C)C(=O)C3=C1C4=C(C3)C(=C(C=C4)OC)OC
InChI
InChI=1S/C23H25NO3/c1-6-24-19-11-14(13(2)3)7-8-16(19)22(25)18-12-17-15(21(18)24)9-10-20(26-4)23(17)27-5/h7-11,13H,6,12H2,1-5H3
InChIKey
CBKBXXRWNJLPGE-UHFFFAOYSA-N
Compound name
5-ethyl-1,2-dimethoxy-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

363.18344 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.19072 189.9
[M+Na]+ 386.17266 200.7
[M-H]- 362.17616 195.8
[M+NH4]+ 381.21726 206.9
[M+K]+ 402.14660 195.3
[M+H-H2O]+ 346.18070 182.0
[M+HCOO]- 408.18164 207.7
[M+CH3COO]- 422.19729 223.2
[M+Na-2H]- 384.15811 190.6
[M]+ 363.18289 197.5
[M]- 363.18399 197.5
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.