CID 11434929

2-furancarboxaldehyde, tetrahydro-5-oxo-, (2r)-

Structural Information

Molecular Formula

C₅H₆O₃

SMILES

C1CC(=O)O[C@H]1C=O

InChI

InChI=1S/C5H6O3/c6-3-4-1-2-5(7)8-4/h3-4H,1-2H2/t4-/m1/s1

InChIKey

ZFXZBQWFIKDIQK-SCSAIBSYSA-N

Compound name

(2R)-5-oxooxolane-2-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 114.03169 Da
Monoisotopic Mass: -0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	115.03897	119.6
[M+Na]+	137.02091	129.9
[M+NH4]+	132.06551	127.7
[M+K]+	152.99485	127.3
[M-H]-	113.02441	121.1
[M+Na-2H]-	135.00636	123.3
[M]+	114.03114	121.2
[M]-	114.03224	121.2

Literature stripe

literature stripe

Patent stripe

patents stripe