CID 346940

2-(4-bromophenyl)indolizine

Structural Information

Molecular Formula
C14H10BrN
SMILES
C1=CC2=CC(=CN2C=C1)C3=CC=C(C=C3)Br
InChI
InChI=1S/C14H10BrN/c15-13-6-4-11(5-7-13)12-9-14-3-1-2-8-16(14)10-12/h1-10H
InChIKey
QQJSQCXEFBNJIZ-UHFFFAOYSA-N
Compound name
2-(4-bromophenyl)indolizine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

24
Patents

270.99966 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.00694 153.5
[M+Na]+ 293.98888 167.3
[M-H]- 269.99238 163.1
[M+NH4]+ 289.03348 175.3
[M+K]+ 309.96282 155.0
[M+H-H2O]+ 253.99692 153.1
[M+HCOO]- 315.99786 176.2
[M+CH3COO]- 330.01351 169.2
[M+Na-2H]- 291.97433 162.0
[M]+ 270.99911 173.5
[M]- 271.00021 173.5
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

patents stripe