CID 346948

2-(4-methylphenyl)indolizine

Structural Information

Molecular Formula
C15H13N
SMILES
CC1=CC=C(C=C1)C2=CN3C=CC=CC3=C2
InChI
InChI=1S/C15H13N/c1-12-5-7-13(8-6-12)14-10-15-4-2-3-9-16(15)11-14/h2-11H,1H3
InChIKey
DCLHWYSXBSMRRM-UHFFFAOYSA-N
Compound name
2-(4-methylphenyl)indolizine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

48
Patents

207.1048 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.11208 144.8
[M+Na]+ 230.09402 162.1
[M+NH4]+ 225.13862 155.6
[M+K]+ 246.06796 154.2
[M-H]- 206.09752 150.6
[M+Na-2H]- 228.07947 155.9
[M]+ 207.10425 149.2
[M]- 207.10535 149.2
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

patents stripe