CID 393625

3-(4-methoxyphenyl)-1-methyl-2-phenylindolizine

Structural Information

Molecular Formula
C22H19NO
SMILES
CC1=C2C=CC=CN2C(=C1C3=CC=CC=C3)C4=CC=C(C=C4)OC
InChI
InChI=1S/C22H19NO/c1-16-20-10-6-7-15-23(20)22(18-11-13-19(24-2)14-12-18)21(16)17-8-4-3-5-9-17/h3-15H,1-2H3
InChIKey
SWYZMSOBTNLJSA-UHFFFAOYSA-N
Compound name
3-(4-methoxyphenyl)-1-methyl-2-phenylindolizine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.14667 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.15395 175.5
[M+Na]+ 336.13589 185.8
[M-H]- 312.13939 185.8
[M+NH4]+ 331.18049 191.6
[M+K]+ 352.10983 179.1
[M+H-H2O]+ 296.14393 166.0
[M+HCOO]- 358.14487 199.1
[M+CH3COO]- 372.16052 187.9
[M+Na-2H]- 334.12134 179.5
[M]+ 313.14612 178.9
[M]- 313.14722 178.9
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.