CID 63935453

4-cyclopropanecarbonyloxane

Structural Information

Molecular Formula

C₉H₁₄O₂

SMILES

C1CC1C(=O)C2CCOCC2

InChI

InChI=1S/C9H14O2/c10-9(7-1-2-7)8-3-5-11-6-4-8/h7-8H,1-6H2

InChIKey

HCKXQRPKQKTOBL-UHFFFAOYSA-N

Compound name

cyclopropyl(oxan-4-yl)methanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 154.09938 Da
Monoisotopic Mass: 0.7
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]+	155.10666	132.6
[M+Na]+	177.08860	139.0
[M-H]-	153.09210	140.1
[M+NH4]+	172.13320	147.1
[M+K]+	193.06254	139.1
[M+H-H2O]+	137.09664	126.0
[M+HCOO]-	199.09758	151.9
[M+CH3COO]-	213.11323	178.5
[M+Na-2H]-	175.07405	138.2
[M]+	154.09883	131.7
[M]-	154.09993	131.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe