CID 43150985

2-(furan-2-yl)azetidine

Structural Information

Molecular Formula
C7H9NO
SMILES
C1CNC1C2=CC=CO2
InChI
InChI=1S/C7H9NO/c1-2-7(9-5-1)6-3-4-8-6/h1-2,5-6,8H,3-4H2
InChIKey
FXSBCJGVJOJKSE-UHFFFAOYSA-N
Compound name
2-(furan-2-yl)azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

123.06841 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.07569 116.3
[M+Na]+ 146.05763 122.4
[M-H]- 122.06113 120.9
[M+NH4]+ 141.10223 130.5
[M+K]+ 162.03157 124.8
[M+H-H2O]+ 106.06567 105.8
[M+HCOO]- 168.06661 137.2
[M+CH3COO]- 182.08226 169.3
[M+Na-2H]- 144.04308 123.7
[M]+ 123.06786 122.8
[M]- 123.06896 122.8
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