CID 346941

2-(4-chlorophenyl)indolizine

Structural Information

Molecular Formula
C14H10ClN
SMILES
C1=CC2=CC(=CN2C=C1)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C14H10ClN/c15-13-6-4-11(5-7-13)12-9-14-3-1-2-8-16(14)10-12/h1-10H
InChIKey
JUFKIZACGBFMPH-UHFFFAOYSA-N
Compound name
2-(4-chlorophenyl)indolizine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

6
Patents

227.05017 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.05745 147.5
[M+Na]+ 250.03939 159.3
[M-H]- 226.04289 154.4
[M+NH4]+ 245.08399 168.2
[M+K]+ 266.01333 152.6
[M+H-H2O]+ 210.04743 140.5
[M+HCOO]- 272.04837 167.9
[M+CH3COO]- 286.06402 161.7
[M+Na-2H]- 248.02484 154.7
[M]+ 227.04962 150.9
[M]- 227.05072 150.9
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