CID 155858666

2580202-36-2

Structural Information

Molecular Formula

C₇H₁₀O₄

SMILES

C=CC1(COC1)OCC(=O)O

InChI

InChI=1S/C7H10O4/c1-2-7(4-10-5-7)11-3-6(8)9/h2H,1,3-5H2,(H,8,9)

InChIKey

POTJUFZKJAVZIH-UHFFFAOYSA-N

Compound name

2-(3-ethenyloxetan-3-yl)oxyacetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 158.0579 Da
Monoisotopic Mass: -0.2
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]+	159.06518	133.5
[M+Na]+	181.04712	138.3
[M+NH4]+	176.09172	137.3
[M+K]+	197.02106	135.1
[M-H]-	157.05062	130.9
[M+Na-2H]-	179.03257	135.1
[M]+	158.05735	132.1
[M]-	158.05845	132.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.