CID 139022486

2344684-98-4

Structural Information

Molecular Formula
C7H12O3
SMILES
COCOC1CC(C1)C=O
InChI
InChI=1S/C7H12O3/c1-9-5-10-7-2-6(3-7)4-8/h4,6-7H,2-3,5H2,1H3
InChIKey
JLCXDRUDGJFARZ-UHFFFAOYSA-N
Compound name
3-(methoxymethoxy)cyclobutane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.07864 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.08592 124.1
[M+Na]+ 167.06786 130.2
[M-H]- 143.07136 127.7
[M+NH4]+ 162.11246 139.2
[M+K]+ 183.04180 133.6
[M+H-H2O]+ 127.07590 114.3
[M+HCOO]- 189.07684 146.8
[M+CH3COO]- 203.09249 178.0
[M+Na-2H]- 165.05331 130.1
[M]+ 144.07809 135.5
[M]- 144.07919 135.5
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

No patent data available for this compound.