CID 58398151

3-(methoxymethyl)cyclopentan-1-one

Structural Information

Molecular Formula
C7H12O2
SMILES
COCC1CCC(=O)C1
InChI
InChI=1S/C7H12O2/c1-9-5-6-2-3-7(8)4-6/h6H,2-5H2,1H3
InChIKey
VODWVODTWFOXGS-UHFFFAOYSA-N
Compound name
3-(methoxymethyl)cyclopentan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

128.08372 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.09100 126.6
[M+Na]+ 151.07294 136.6
[M+NH4]+ 146.11754 135.3
[M+K]+ 167.04688 132.7
[M-H]- 127.07644 127.6
[M+Na-2H]- 149.05839 130.8
[M]+ 128.08317 128.0
[M]- 128.08427 128.0
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