CID 16102547

1-[1-[methoxy(phenyl)methyl]-2,3-diphenyl-indolizin-7-yl]ethanone

Structural Information

Molecular Formula
C30H25NO2
SMILES
CC(=O)C1=CC2=C(C(=C(N2C=C1)C3=CC=CC=C3)C4=CC=CC=C4)C(C5=CC=CC=C5)OC
InChI
InChI=1S/C30H25NO2/c1-21(32)25-18-19-31-26(20-25)28(30(33-2)24-16-10-5-11-17-24)27(22-12-6-3-7-13-22)29(31)23-14-8-4-9-15-23/h3-20,30H,1-2H3
InChIKey
WFHOTVMNNOWOOB-UHFFFAOYSA-N
Compound name
1-[1-[methoxy(phenyl)methyl]-2,3-diphenylindolizin-7-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

431.18854 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 432.19582 209.2
[M+Na]+ 454.17776 216.0
[M-H]- 430.18126 221.4
[M+NH4]+ 449.22236 218.9
[M+K]+ 470.15170 208.6
[M+H-H2O]+ 414.18580 197.3
[M+HCOO]- 476.18674 229.0
[M+CH3COO]- 490.20239 218.1
[M+Na-2H]- 452.16321 208.6
[M]+ 431.18799 211.5
[M]- 431.18909 211.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.