CID 5272726

2-(furan-2-yl)indolizine

Structural Information

Molecular Formula
C12H9NO
SMILES
C1=CC2=CC(=CN2C=C1)C3=CC=CO3
InChI
InChI=1S/C12H9NO/c1-2-6-13-9-10(8-11(13)4-1)12-5-3-7-14-12/h1-9H
InChIKey
UGGLREXOFWHWIW-UHFFFAOYSA-N
Compound name
2-(furan-2-yl)indolizine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

183.06842 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.075696 134.7
[M+Na]+ 206.057638 145.7
[M-H]- 182.061144 142.8
[M+NH4]+ 201.102243 156.7
[M+K]+ 222.031578 143.4
[M+H-H2O]+ 166.065680 128.6
[M+HCOO]- 228.066621 160.8
[M+CH3COO]- 242.082271 150.3
[M+Na-2H]- 204.043086 142.4
[M]+ 183.06787142 138.0
[M]- 183.06896858 138.0
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

patents stripe