CID 12563868

3-ethoxycyclobutan-1-one

Structural Information

Molecular Formula
C6H10O2
SMILES
CCOC1CC(=O)C1
InChI
InChI=1S/C6H10O2/c1-2-8-6-3-5(7)4-6/h6H,2-4H2,1H3
InChIKey
LVHZHHKPKYYHKS-UHFFFAOYSA-N
Compound name
3-ethoxycyclobutan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

114.06808 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.07536 120.6
[M+Na]+ 137.05730 127.2
[M+NH4]+ 132.10190 125.2
[M+K]+ 153.03124 123.9
[M-H]- 113.06080 118.9
[M+Na-2H]- 135.04275 123.3
[M]+ 114.06753 119.7
[M]- 114.06863 119.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe